S E C T I O N

S

O

L

I

D

S T A T E

V l

P R O P E R T I E S

C r y s t a l l o g r a p h i c f o r

D a t a

V a r i o u s

a n d

M e l t i n g

P o i n t s

P o l y m e r s

R o b e r t L. M i l l e r Michigan Molecular Institute, 1910 West St. Andrew Rd., Midland, Ml 48640, USA

A. Introduction 1. Nomenclature 2. Examples of Polymer Names 2.1. Polymer Names Based on Source 2.2. Polymer Names Based on Structure References for Introduction B. Crystallographic Data for Various Polymers Table 1. Poly(olefins) Table 2. Poly(vinyls) and Poly(vinylidenes) Table 3. Poly(aromatics) and Poly(imides) Table 4. Poly(dienes) and Poly(diynes) Table 5. Poly(peptides) Table 6. Poly(amides) Table 7. Poly(esters) Table 8. Poly(urethanes) and Poly(ureas) Table 9. Poly(ethers) Table 10. Poly(oxides) Table 11. Poly(sulfides) and Poly(sulfones) Table 12. Poly(saccharides) Table 13. Other Polymers C. Melting Points of Polymers D. Appendix: Formula Index to the Tables E. References

A.

Vl-I Vl-I VI-2 VI-2 VI-3 VI-5 VI-5 VI-6 Vl-13 Vl-15 VI-22 VI-26 VI-33 VI-40 VI-49 VI-51 VI-52 VI-57 VI-59 VI-64 VI-71 Vl-113 VI-159

INTRODUCTION

These tables contain data for approximately 2700 polymers. In general, the format and organization of the tables follows that used in the 2nd edition of the "Polymer Handbook" (Section B: Crystallographic Data; Section C: Melting Points; Section D: Formula Index and Section E: References). The Formula Index is included as an aid to the searcher: it permits one to determine the polymer name used in these tables from the structural line formula for the polymer of interest. To avoid the duplication of data for polymers appearing in both the Crystallographic Data and Melting Point tables, the entry in the Melting Point table has been flagged with an asterisk (*).

1. Nomenclature

Contrary to the rest of the Polymer Handbook, the ACSIUPAC nomenclature proposals (1,2) for naming regular single-strand organic polymers have not been adopted for these tables. Basically, the nomenclature used in this portion of the Polymer Handbook is that of the 1st and 2nd editions and of the 1967 recommendations of the IUPAC Nomenclature Committee (3). The majority of polymers were named as the bivalent radical(s) comprising the constitutional repeating unit (CRU), with priority in naming given to (a) incorporation of important structural features (amide, ester, oxide, etc.) and (b) emphasis on symmetry of the CRU (when present). As in the past, many common polymers (poly(styrene), poly(vinyl chloride), etc.) were named according to source names. In the majority of cases, the polymer was named according to its structure, particularly when the CRU was composed of two or more subunits following each other in a regular fashion. An example is poly(ethylene terephthalate). With more complicated structures, the CRU was divided into its possible subunits, each of which was treated as a bivalent radical and so named. One of the subunits was treated as the parent compound, for example, the "terephthalic acid" of the above example. For poly(amides) and poly(esters), the acid was chosen as the parent compound; for poly(urethanes) it was the isocyanate. Whenever the CRU (or a portion thereof) exhibited a center of symmetry, naming began with the central subunit using Chemical Abstracts/IUPAC names for the constituent bivalent radicals (see under examples). Conjunctive names were used as needed in constructing names. For symmetrical units, this process of naming could be continued indefinitely. Unsymmetrical bivalent units were named with replacement nomenclature, or from end to end, depending upon the complexity of the bivalent radical and the ease of naming by the alternative choices. Replacement nomenclature was used, for example, to name poly(hexamethylene 6-oxaheptadecanediamide). The polymer from the symmetrical oxyacid would be named poly(hexamethylene oxydicaprylamide).

More complicated structures without symmetry were named end to end. This method was particularly appropriate for the poly(oxides) of the form -(R-O-R'-O^ (and for the analogous sulfides, sulfones, ureas, and anhydrides) and for the poly(co-amino acids) and for the poly (G)-hydroxy acids). The constitutional hydrocarbon subunits were ordered alphabetically in naming the polymer as, for example, in poly(methyleneoxy pentamethylene oxide). For silicon-containing polymers, bivalent radical names replaced the source-based silane/siloxane names. For

example, the source-named polymer, poly[(tetramethylsilphenylene) siloxane], appears in these tables as poly(/?phenylene tetramethyldisiloxanylene). For the regular polymers of multipeptides, a cyclic permutation of the individual peptide residues in the constitutional base unit was performed to permit alphabetical ordering without loss of directional or sequential sense. Thus, poly(alanylglycyl-proline) is the name given to polymers prepared form (ala-gly-pro), (gly-pro-ala), and (pro-ala-gly), but not from (ala-pro-gly) or from either of its cyclic permutations.

2. Examples of Polymer Names 2.1. Polymer Names Based on Source Olefin, Vinyl, and Acyclic Polymers [-CH 2 -CH 2 -J n

Poly(ethylene)

[-CH-CH2-Jn

PoIy(I-butene)

I

CH 2 -CH 3 [-CH-CH 2 -] n

Poly(acrylonitrile)

I

CN [-CH-CH 2 -J n

Poly(vinyl chloride)

I

Cl

[-CH-CH2-Jn

Poly(methyl acrylate)

I

COOCH3 Poly(amides)l [-NH-CH 2 -COO-J n

Poly(glycine)

[-NH-(CH 2 ) 2 -COO-] n

Poly(3-aminopropionic acid) (poly (|3-alanine))

[-NH-(CH 2 ) 3 -COO-] n

Poly(4-aminobuyric acid)

[-NH-(CH 2 ) 4 -COO-] n

Poly(5-aminovaleric acid)

[-NH-(CH 2 ) 5 -COO-] n

Poly(6-aminocaproic acid)

[-NH-(CH 2 ) 6 -COO-] n

Poly(7-aminoenanthic acid)

[-NH-(CH 2 ) 7 -COO-] n

Poly(8-aminocaprylic acid)

[-NH-(CH 2 ) 8 -COO-L

Poly(9-aminopelargonic acid)

[-NH-(CH 2 ) 9 -COO-] n

Poly(10-aminocapric acid)

[-NH-(CH 2 ) lo-COO-] „

PoIy(11-aminoundecanoic acid)

[-NH-(CH2)n-C00-]n

PoIy(12-aminolauric acid)

Poly(oxides) [-CH 2 -O-J n

Poly(oxymethylene)

[-CHO-Jn

Poly(acetaldehyde)

I

CH3 1

Poly(esters) are treated similarly.

Poly(ethylene oxide) Poly(propylene oxide)

Poly(trimethylene oxide)

2.2.

Polymer Names Based on Structure

(a) Linking Radicals Ethylene Trimethylene Oxydiethylene Ethylenedioxy-diethylene Sulfonyldiethylene

methylphosphinidene-ditrimethylene /?-Phenylenediethylene 4,4/-Biphenylenediethylene 4,4 '-Methylenediphenylene 4,4 '-Ethylidenediphenylene

4,4 '-Isopropylidenediphenylene

4,4 '-Butylidenediphenylene

4,4'-(2,2-Butylidene)diphenylene 4,4 '-Oxydiphenylene

4,4 '-Sulfonyldiphenylene

(b) Parent Compounds Oxalate (oxamide) Malonate (malonamide) Succinate (succinamide) Glutarate (glutaramide)

References page VI-159

Adipate (adipamide) Pimelate (pimelamide) Suberate (suberamide) Azelaate (azelaamide) Sebacate (sebacamide) Nonanedioate (nonanediamide) Oxydipropionate p-Phenylene diacetate /7-Phenylenedipropionate 4,4'-DIbCnZOaIe 4,4 '-Methylenedibenzoate 4,4 '-Oxydibenzoate

4,4' -Sulfonyldibenzoate

4,4' -Oxy dipheny lenediacetate 4,4 /-(Ethylenedioxy)dibenzoate /?-(Phenylenedioxy)diacetate (p-Carboxyphenoxy)acetate 1,4-Piperazinediacetate (c) Polymer Names

Poly(esters)2 Poly(ethylene terephthalate) Poly(ethylene 4,4'-dibenzoate) Poly(ethylenep-phenylenediacetate)

Poly(ethylene 4,4 '-isopropylidenedibenzoate)

Poly(ethylene 4,4 '-sulfonyldibenzoate)

Poly(urethanes) Poly(trimethylene ethylene-urethane) 2

Poly(amides) are treated similarly.

Poly(oxides), Poly(sulfides), Poly(amines) Poly(ethylene trimethylene oxide) Poly(ethylene trimethylene sulfide) Poly(ethylene trimethylene amine)

REFERENCES FOR INTRODUCTION 1. ACS Structure-based Nomenclature for Linear Polymers, Macromolecules, 1, 193 (1968). 2. IUPAC Appendices on Tentative Nomenclature, Symbols, Units, and Standards - Number 29, Nomenclature of Regular Single-strand Organic Polymers, November 1972 - Macromolecules, 6, 149 (1973). 3. 1967 IUPAC Report on Nomenclature, J. Polym. Sci. B, 6, 257 (1968). B. CRYSTALLOGRAPHIC DATA FOR VARIOUS POLYMERS

The following table presents crystallographic data for about 750 polymers (and for their many polymorphs) grouped, according to the generic structure of the constitutional base unit, into poly(olefins), poly(vinyls) and poly(vinylidenes), poly(aromatics) and poly(imides), poly(dienes) and poly(diynes), poly(peptides), poly(amides), poly(esters), poly(urethanes) and poly(ureas), poly(ethers), poly(oxides), poly(sulfides) and poly(sulfones), poly(saccharides), and other polymers. Where a polymer might be included in more than one group the following group definitions were used: 1. Poly(olefins): those olefin polymers not containing aromatic rings; all substituted derivatives of these, excluding the vinyl and vinylidene polymers. For example, poly(ethylene), poly(tetrafluoroethylene), and poly(cyclopentene), but not poly(styrene) or poly(vinyl chloride). 2. Poly(vinyls) and Poly(vinylidenes): those vinyl and vinylidene polymers containing atoms other than carbon and hydrogen, excepting the poly(ethers). Thus, poly(vinyl chloride) but not poly(methylvinyl ether). 3. Poly(aromatics) and Poly(imides): those hydrocarbon polymers containing aromatic rings, including heterocyclic ones. Thus, poly(styrene), poly(p-xylylene), and poly(p-phenylene pyromellitimide). 4. Poly(peptides): those polymers whose basic structure, ignoring substituents, is poly(2-aminoacetic acid), that is, poly(glycine). This group contains mainly the synthetic poly(oc-amino acids). 5. Poly(amides): all amide polymers except the poly(ocamino acids), which are separately grouped under poly(peptides). 6. The remaining categories contain polymers according to functional groups as, for example, the poly(esters). Poly(ethers) and poly(oxides) are differentiated accord-

ing to whether the ether linkage is in the side-group or in the chain backbone, respectively. For example, poly(l-butoxy-2-chloroethylene) is a poly (ether) and poly(oxymethylene) is a poly(oxide). 7. Those polymers not otherwise categorized, such as the poly(phosphazenes) and the poly(siloxanes), are grouped in the "other" category. Within each group, polymers are listed alphabetically according to the basic structure, ignoring substituents (excepting the polypeptides, all of which have the same base structure). Substituted polymers are listed alphabetically according to the substituent under the entry for the unsubstituted polymer. Thus, poly(tetrafluoroethylene) and poly(4-methyl-l-pentene) appear, respectively, under polyethylene) and poly(l-pentene). Included as part of the polymer name column is the molecular weight of the chemical repeat unit of the chain, that is, of the constitutional base unit. This is given in parentheses just below the polymer name. The values reported are in grams per mole. Unless otherwise indicated, the reference cited in the last column applies to all of the data in that line of the tables. Where an entry in a line has been taken from a source different from that listed in the reference column, a solidus (/) separates the value of the entry from the reference citation. For example, one value of the melting point of poly(l-butene) is given as "126/12" which is to be read as "126°C according to Ref. 12". The crystal system, where known, is given in column 2 of the table, using the abbreviations given later. The next column contains the space group symbol (the Schoenflies notation is used because of the limitations of common printers at mainframe installations) with the subscript portion of the symbol preceding the superscript portion. Thus, according to Ref. 14, the poly(ethylene) unit cell is orthorhombic (Ortho) with space group D ^ (D2h-16). For a fuller discussion of space group symbols, see "International Tables for X-Ray Crystallography", Vol. I, Kynoch Press, Birmingham, England, 1952. The dimensions of the unit cell (a, b, c) are given next, in Angstroms (1 A = 0.1nm). c is the fiber axis. Unless otherwise indicated, the unit cell angles are all 90°. Where only one angle differs from 90°, its value is given. When all three angles differ from 90°, their values are listed in the order a, /3, 7. The next column contains the number of constitutional base units in the unit cell described. Columns 9 and 10 contain the densities of the completely crystalline and of the completely amorphous polymer, respectively. The values given, normally approReferences page VI-159

priate to room temperature, are in grams per cubic centimeter (lg/cm 3 = 103kg/m3). For uniformity crystallographic densities (column 9) have been recalculated on the basis of the 1969 IUPAC atomic weight values. Melting points in degrees Celsius and heats of fusion in kilojoules per mole are listed in the next two columns. The heats of fusion correspond to the amount of substance represented by the molecular weight associated with each polymer name. Column 13 of the tables indicate briefly the conformation of the polymer chain in the crystal (in a helical notation) either as reported in the reference cited or as inferred from the value of the fiber axis. The designation n *p/q specifies the number (n) of skeletal atoms in the asymmetric unit of the chain and the number of such asymmetric units (p) per q turns of the helix in the crystallographic repeat. Thus, poly(ethylene), as listed, has two carbon atoms in the backbone with one such unit per turn in the repeat - it is designated as a 2*1/1 helix. Alternatively, poly(ethylene) considered a poly(methylene) would be designated as a 1*2/1 helix - an entirely equivalent description of the conformation. Note that n may differ from the number of chain atoms in the constitutional base unit. On the one hand, isotactic poly(propene) has two skeletal atoms in the asymmetric unit and three units per turn (2*3/1). On the other hand, syndiotactic poly(propene) with the same constitutional base unit as isotactic

poly(propene) has four skeletal atoms in the asymmetric unit and two units per turn (4 * 2/1). In this case, n signifies the number of skeletal atoms in the stereobase unit. A fuller discussion of this helical notation is given in Hughes and Lauer, J. Chem. Phys., 30, 1165 (1959) and in Nagai and Kobayashi, J. Chem. Phys., 36, 1268 (1961). This list of polymers and data is not considered to be exhaustive. The compiler expands it as new information is unearthed and he is quite receptive to notification of omissions and/or corrections and to submission of unpublished data. AU of the data in this table cannot be considered to have the same validity - the number of polymers for which detailed, accurate, and reliable crystal structure analyses have been conducted is still quite limited. The reader may find it desirable to refer to the original literature cited so as to gain a fuller appreciation of the reasons for apparent discrepancies within the tables. The following abbrevaitions have been used in the tables. Tri Mono Ortho Tet Rho Hex P Phex

Triclinic Monoclinic Orthorhombic Tetragonal Rhombohedral (trigonal) Hexagonal Pseudo Pseudohexagonal

TABLE 1. POLY(OLEFINS) (-HCH-CHR-) Density (g/cm3)

Unit cell parameters Polymer Poly(acetylene) transI. (26.04)

II. c/s-transoid

Cryst syst.

Phex Mono Ortho Ortho Ortho Mono Port Ortho Ortho Ortho Ortho

Space group

D2h-16

C2h-5 C2h-5

Ortho Mono

D2h-16

Ortho Ortho Ortho Ortho Ortho

D2h-16

Orhto

D2h-16

D2h-16

a

b

c

4.2 4.26 7.32 7.37 5.62 4.24 7.41 3.99 7.20 7.31 7.26 7.46 7.38 7.330 3.73

4.2 7.33 4.24 4.065 4.92 7.32 4.08 7.29 4.15 4.06 4.24 4.08 4.09 4.090 3.73

2.43 2.46 2.46 2.45 2.592 2.46 2.48 2.51 2.44 2.45 2.47 2.46 2.457 2.457 2.44

7.61 7.74 7.68 7.45 7.62 7.61 7.66 7.62

4.39 4.32 4.46 4.30 4.46 4.39 4.42 4.44

5.12

5.12

Angles

Heat of fusion kj/mola

Chain conform. (n*p/q) Refs.

z

Crystal.

1 2 2 2 2 2 2 2 2 2 2 2 2 2 1

1.16 1.126 1.33 1.178 1.207 1.133 1.153 1.184 1.186 1.189 1.137 1.155 1.166 1.174 1.286

2*1/1 2*1/1 2*1/1 2*1/1 2*1/1 2*1/1 2*1/1 2*1/1 2*1/1 2*1/1 2*1/1 2*1/1 2*1/1 2*1/1 2*1/1

69 982 981 979 980 1213 1228 1229 1281 1282 1283 1323 1324 1369 980

4.47* 4.47 4.38 4.40* 4.38 4.36* 4.384 4.384

4 4 4 4 4 4 4 4

1.158 1.157 1.153 1.227 1.162 1.187 1.165 1.166

2*2/1 2*2/1 2*2/1 2*2/1 2*2/1 2*2/1 2*2/1 2*2/1

945 976 978 1229 1282 1323 1324 1369

4.84

3

1.180

2*3/1

977

/3 = 91.4

(3 = 91.5

7 = 98

Amorph."

Melting point (0C)*

czs-cisoid Hex

TABLE 1. cont'd Density (g/cm3)

Unit cell parameters Polymer -, difluorotrans(62.02) cis-, complex with: alkali metals Cs I. K I. II. Na I. Rb I. II. SbF6 and Poly(allene) 1.(40.06) II.

Cryst syst.

Space group

c

Ortho

7.58

4.29

Ortho

8.03

4.47

Tet

9.09

9.09

1230

Tet Ortho

8.46 5.94

8.46 16.37

1230 1231

Tet

8.5

8.5

1230

Tet Ortho

8.75 6.16

8.75 16.68

1230 1231

Mono Hex

8.66 9.8

7.36 9.8

2.4 5.4

8.20 6.37

7.81 5.12

3.88 3.88*

D2h-6 C2-2 or C2h-2

z

Crystal.

2.48

2

2.554

2*1/1

1385

4.64

4

2.473

2*2/1

1385

7 = 101

7 = 96.6

1261 1261 4 2

1.071 1.058

122/536

3.88

C4-2 or D4-3 Poly(allylbenzene), see Poly(propene) 3-phenylPoIy(I-butene) isotactic I. Rho D3d-6 (56.11) Hex Rho

II.

Chain conform. (n*p/q) Refs.

b

III. -, tetrafluoro(112.03)

Amorph.a

Heat of fusion kj/mola

a

Ortho Mono

Angles

Melting point (°C)a

Tet

Tet Tet Tet Tet Tet

S4-1 S4-1

D2d-7

6.88

6.88

17.7 17.3 17.70

17.7 17.3 17.70

15.4

8

6.50 6.7 6.51

18 18 18

2.042

0.951 0.96 0.950 0.950 0.95 0.95/12

126

0.87 0.868 0.860

0.819 0.886 0.902 0.888

126/12 132/250 133 136/277 139 135/320

15.42 14.89 14.85 14.91 14.5

15.42 14.89 18.85 14.91 14.5

21.05 20.87 20.6 20.76 21.1

44 44 44 44 44

130/380 124/277 126/313 120 122/320

8.96 8.88 8.92

(7.6) 7.56 7.45 7.6

8 8 8

(0.876) 0.897 0.906

106/277 110/984

8 8 22

0.937 0.946 0.964?

45

4 8 16 16 64 16

0.933 0.933 0.890 0.918 0.925 0.948

300/48 306/632 310/90 300/282

13.9/82 6.07/277 7.57 8.0/1285 7.01 6.92/320 138/380 142/984 142/313 4.06/320 6.28/277 6.9/1285 8.16

2*2/1 2*2/1

497 497

2*2/1

497

2*8/1

38

2*3/1 2*3/1 2*3/1

35 45 1284 252 983 391

2*11/3 2*11/3 2*11/3 2*11/3 *40//ll

866 207 350 1284 914 1195 207 876 531 461

0.868 III.

syndiotactic I. II. - , 3-methyl(70.14)

Ortho Ortho

D2-4

12.49 12.38 12.38

Ortho Ortho Mono

D2-5 D2-5 C2-2

16.9 16.81 9.94

6.05 6.06 13.9

7.78 7.73 20.4 20.0

9.55 9.55 19.1 19.25 34.3 19.25

8.54 17.08 17.8 17.20 34.3 17.20

6.84 6.84 6.85 6.85 6.85 6.63

Mono Mono Mono Port Tet Mono

C2h-5

C4v-12

7 =116.5 7-116.5 7=116 7=116.5 7 = 116.5

6.49/277 2*4/1 2*4/1 2*4/1

17.3/82

4*2/1 4*2/1 4*5/3

1435 1449 1435 1449

2*4/1 2*4/1 2*4/1 2*4/1 2*4/1 2*4/1

9 549 231 355 431 280

References page VI-159

TABLE 1. cont'd Density (g/cm3)

Unit cell parameters Polymer

Cryst syst.

Space group

- , 3-methyl- [1,3-via hydride shift] (70.14) - , 4-phenyl(132.21)

Port

CS-2

a

b

5.4

10.4

c

Angles

z

Crystal.

Amorph.a

7.8

18.0

6.61 6.55

Poly( 1,3-cyclobutylene) - , 1-cyano(79.10) Poly (1,2-cycloheptylene-a/f-ethylene) (124.23) Poly (1,2-cyclopentylene-afr-ethylene) (96.17) Ortho Ortho D2h-17 or D2h-14 Poly( 1,3-cyclopentylene-a/Mnethylene) (82.15) Ortho Ortho Poly(decenamer) transIll. Tri Ci-I (138.25) IV. Mono C2h-5 PoIy(I-decene) 1.(140.27) PoIy(I-docosene) 1.(308.59) II. III. Poly(dodecenamer) transIll. (166.31) IV.

10.97

20.02

6.46

10.92

7.73

9.10

9.86

9.86

5.02 5

6

1.064

0.962

single crystal II.

a = 130

6

0.901

4

0.950

3

1.703

0.87

206

2*3/1

772

135

4*2/1

324

4*1/1

635 637

4.36

18.8 13.30

847

9.0

74

9*1/1

259

7.83 8.05

9.02 9.00

4 4

1.032 1.006

185

4*2/1 4*2/1

247 412

7.69 13.30

6.21 15.52

4.80 4.80

2 8

1.190 1.101

146 128

4*1/1 4*1/1

267 340

4.40

5.39

12.30

66,104,118

1

0.985

10*1/1

477

7.42

5.00

12.40

/9 = 94.2

2

1.001

32.9/562 10*1/1

530

80/562

13.2

6.7

Mono

5.3

108

7.7

8

0.93

/3 = 94

8

0.93

Tri

Ci-I

4.40

5.39

14.78

66,104,118

1

0.986

Mono

C2h-5

7.43

5.00

14.85

/3 = 93.5

2

1.003

7.40 7.428 7.36 7.418 7.406 7.407

7.84 4.05

4.93 4.934 4.94 4.946 4.939 4.949

5.56 4.85

2*

150

90 91/872 83 75/949

2*4/1

949

2*4/1 2*

949

12*1/1

477

41.2/562 12*1/1

530

45/48 49/872 49/250

2.534 2.532 2.534 2.546 2.547 2.551

120 2.54

34/250 40/537

80/439 84/562

13.2

Tri Pmono

483 67 1195

3*8/

88

D2h-16

2*3/1 2*3/1

262 264

4.6

370

7.5

D2h-16

158 160/90 159/282 168/187

332

25.3

Ortho

Ortho Ortho Ortho Ortho Ortho Ortho

Chain conform. (n*p/q) Refs.

8.76 8.76

PoIy(I-dodecene) 1.(168.32)

Poly(ethylene) 1.(28.05)

Heat of fusion kj/mola

55 68/319

1.041 - , 4-trimethylsilyl(128.29) Ortho Poly(2-butene-fl/f-ethylene) (84.16) Mono C2h-5 Poly(chlorotrifluoroethylene-tf/f-ethylene) (144.52) Hex

Melting point ( 0 C) a

63,71,82 7 = 105

2 2 2 2 2 2

1.008 1.004 1.011 0.997 1.000 0.9961

96 1

0.999 0.991 1.003 1.004 0.966

0.855 0.887 0.811 0.852

2*

137/85 142/315 141/206 145/351 141/286

8.03/85 8.12/262 7.70/86 8.67/700 7.79/156

146/362

7.62/343 8.37/260

141

8.2

2*1/1 2*1/1 2*1/1 2*1/1 2*1/1 2*1/1

2*1/1 2*1/1

150

14 892 15 535 311 1421 138 363 406 939 72 58

TABLE 1. cont'd Density (g/cm3)

Unit cell parameters Polymer

III. (hi press.) -, chlorotrifluoro(116.47)

-, ethylsilylisotactic (86.21) -, tetrafluoro11.(50.01)

I and IV. (>20°C)

III. (hi press.)

Cryst syst. Pmono Mono Tri Ortho Tet

Space group

C2h-3

Hex Hex Hex Hex Hex

Hex

Phex Tri Tri Mono

C3I-2

a

b

c

7.11 8.09 4.285 8.46 4.26

5.46 4.79 4.820 4.88 4.26

2.534 2.53* 2.54 2.45 8.52

6.34 6.5 6.438 6.385 6.4

6.34 6.5 6.438 6.385 6.4

21.60

21.60

35 35 41.5 42 42.5 43

5.54 4.875 5.59 9.76 5.648 5.61 5.59 5.61 5.66 5.65 5.67

16.8 5.105 16.88 16.88 1.3**

9.50 8.73 8.53

5.05 5.69 5.72

2.62 2.62 2.62

5.59 5.63 5.61

5.59 5.63 5.61

14.34

Hex Ortho Ortho

C2-2

Phex Tri Hex Hex Hex Hex Mono Ortho Ortho

C2h-3 D2h-16 D2h-16

-, trifluoro(82.02)

Hex Hex Hex Poly(ethylene), complexes with: -, perhydrotriphenylene Hex

C6-6 or C6h-2

z

Crystal.

- 96.5 7 = 107.9 90,110,108

2 2 1 2 4

0.953 0.998 1.002 0.920 1.20

14 14 17 17 17 16

2.222 2.11 2.18 2.217 2.18

2.08/49

2.19/49 2.192

1.925 2.032

7

Approx.

6.50

5.54 4.882 5.59 5.59 9.649 5.61 9.52 5.61 5.66 5.65 5.67

17.06 16.8 19.50 19.54

Amorph.a

Angles

18

0.981

7 = 119.5 13 90,87,87 4 7' = 119.3 13 /3 = 90 26 7 2 7=119.3 88,90,92 26 13 15 15

2.406 2.744 2.347 2.344 2.344 2.381 2.358 2.302 2.306

Melting point (°C)a

220/49 210/46 222/341

5.02/88

Chain conform. (n*p/q) Refs. 2*1/1 2*1/1 2*1/1 2*1/1 2*4/1

557 253 254 792 946

2*14/1 2*14/1

208 21 777 296 629 205 139 116

2*17/ 2*17/1 2*16/1 215 2*3/1

2.0/1195

327/46

2.060

330 330/101 346 332/89 334/1357

4 4 4

2.304 2.742 2.552 2.598

2.50 6.75

1 3

2.013 2.205

222/726 213/985

14.34

4.78

2

1.071

181

8.22 8.30

8.22 13.81

11.02 11.00

12.38

6.28

2.5

7 = 105.5

Heat of fusion kj/mola

3.4/1195 1*13/1 1*4/ 1*13/6 1*13/ Irreg 1*13/6 1*13/1 2.87/91 1*13/1 4.10/989 1*15/7 4.64 1*15/ 1*15/7 1*2/1 1*2/1 1*2/1

489

11 266 209 602 987 1286 1321 11 209 988 1286 66 681 857 986

5.4/726 2*1/1 5.44/985 2*3/1

389 854 1192

4*1/1

1124

-, urea (at 83 K) Poly(ethylidene) (28.05)

992 993 4

0.958

100/617

1*2/1

178

51/439

7*2/1

97

17/250

2*3/1 2*3/1

150 359

52/129

2*3/1 2*3/1 2*19/6

67 685 685

195/619 200/618

Poly(heptenamer) transI. (96.17) PoIy(I-heptene) 1.(98.19)

Ortho

D2h-16 orC2v-9

7.40

-, 5-methyl(112.22) (S) Mono C2-2 18.40 (S), (R) Tet S4-1 20.00 PoIy(I-hexadecene) 11.(224.43) Ortho 7.5 Poly(hexafluoroisobutylene-a/f-vinylidene fluoride) (228.08) Ortho C2v-21 10.64

5.00

17.10

4

1.010

6.45

10.62 20.00

6.40 6.36 38.76

63.2 18.37

/? = 90

6 76

0.900 0.913

6.6

8

0.95

68/250

2*4/1

150

7.83

8

1.980

327

4*2/1

947

References page VI-159

TABLE 1. cont'd Density (g/cm3)

Unit cell parameters Polymer PoIy(I-hexene) (84.16) -, 4-methyl(98.19) -, 5-methyl(98.19) Poly(isobutene) (56.11)

Cryst syst.

Space group

Mono Ortho

a

b

c

22.2 11.7

8.89 26.9

13.7 13.7

7 = 94.5

z

Crystal.

-55/48

2*7/2 2*7/2

150 150

28 28

0.845 0.858

200/9 190/632

2*7/2 2*7/1

67 569

3 6

0.835 0.862

130 110/282

2*3/1 2*3/1

9 685

2*8/5 2*8/3

34 801 139

2*4/1

150

2*

493

8*

639

19.64 19.85

19.64 19.85

14.00 13.50

Hex Mono

C2-2

10.2 17.62

10.2 10.17

6.50 6.33

Ortho Ortho

D2-4 D2-4

6.94 6.88

11.96 11.91

18.63 18.60

16 16

0.964 0.978

70.4

6.6

8

0.96

Hex

4.24

0.915 0.912/53 0.842

cis-

44/66

4.24

Tri

Ci-I

4.34

5.41

9.78 9.78

64,105,119

1

1.008

Mono

C2h-5

7.43

5.00

9.90

/3 = 95.2

2

0.999

Mono

C2h-6

4.58

9.50

17.11

(3 = 98

4

0.993

-5

10.9

67/439 73/284 76 77/562 62/439

20.1/284

38 PoIy(I-octene) (at 90K) (112.22) Poly(pentenamer) transI. (68.12) PoIy(I-pentene) isotactic Ia. (70.13)

Mono

Ortho

5.6

C2v-9 orD2h-16

Mono Mono

38

7.28

4.97

11.35 21.15 22.4

20.85 11.20 21.2

Ib. Mono

24.3

19.3

Mono Port

35.65 19.30

20.2 16.90

19.60 21.20

16.75 11.48

Ha.

lib. III. syndiotactic

Port Ortho

D2-4

7.6

0 = 97

11.90

6.49 6.49 6.49* 6.5 6.50* 6.60 7.13* 7.08 7.08 14.39

/3 = 99.6 /3 = 99.6 7 = 91

S4-1

20.3 20.35

20.3 20.35

8*1/1 25.3 23.8/562 8*1/1

126 476 1377 530

8*2/1

905 1376

2*4/1

1209

21.0

8

0.93

5 10-38/48 10/872

4

1.051

23 34/682

12.0/682 5*2/1

147

12 12 24

0.923 0.922 0.907 0.96

130/276 130/380 111/501

6.28/501 2*3/1 2*3/1 2*3/1

2*4/1 2*4/1

355 355 931 408 355 931 152 818 355

2*4/1 2*7/2

355 834

7 = 96

24

0.922

7 = 91 7 = 116

40 16

0.907 0.898

7=115.3

16 28

0.887 0.931

0.85 2*3/1 2*3/1 75/48 78/282 80/9 79/501

42 -, 5-amino-, -, Af,iV-diisobutyl(197.37) -, -, Af,Af-diisopropyl(169.31) - , 4,4-dimethyl(98.19) Tet Tet

12.0/82

80/6 100/90

0.867 IV.

Chain conform. (n*p/q) Refs.

0.726 0.908

Cl-I

(3 = 90

Amorph.a

Heat of fusion kj/mola

14 28

Tet Tet

Poly(norbornene), see PoIy(I -vinylene-3-methylene) Poly (1 -octadecene) 11.(252.49) Ortho 7.5 III. Poly(octamethylene) -, 1-methyl(126.24) Poly(octenamer) transIll. (110.20)

Angles

Melting point (°C)a

4.00/501

2.94

1452

6.85

112

2*

191

7.32

130

2*

191

231/282 350/90 380/441

2*7/2 2*4/1

431 442

13.8 7.01

28 16

0.803 0.899

TABLE 1. cont'd Density (g/cm3)

Unit cell parameters Polymer - , 5-hydroxy(86.13) - , 3-methyl(84.16)

- , 4-methylisotactic I. (84.16)

Cryst syst.

Space group

III.

quenched syndiotactic I.

II. III.

Angles

z

Crystal.

C4-6

13.35

13.35

6.80

8

0.922

Tet Tet Tet Tet Tet Tet Tet Tet Tet

S4-1

18.66 18.70 18.53 18.54 18.50 18.60 18.63 18.70 18.66

18.66 18.70 18.53 18.54 18.50 18.60 18.63 18.70 18.66

13.80 13.54 13.76 13.84 13.76 13.85 13.85 13.68 13.65

28 28 28 28 28 28 28 28 28

19.16 19.36 19.38 19.46

19.16 19.36 19.38 19.46

16 16 16 16

0.814 0.826 0.828 0.822 0.831 0.817 0.814 0.818 0.823 0.828 0.855 0.846 0.853 0.8408

16.88 22.17

16.88 22.17

18 18

0.808 0.883?

18.03

18.03

48

0.880

S4-1 D2d-7

C4-6

Hex Hex Tet

II.

c

Tet

Tet Tet

- , 5-trimethylsilyl(142.32) Poly(propene) isotactic I. (42.08)

b

Amorph.a

Heat of fusion kj/mol a

6.5

II. III.

IV. (hi press) V. syndiotactic

a

Melting point (°C)a

S4-1

7.12 7.05 6.98 7.022 6.5 6.31 6.69 46.91

362/632 273/129 200/441

>0.835

Hex Rho Rho Ortho Hex Rho Ortho Rho Tri Tri Ortho Tet Ortho Ortho Ortho Phex Ortho

C2h-6 Ci-I C2h-5

C2h-5 C2h-3 C2h-5

D3-4

C3-2

D2h-24

D2-2 D2-5 D2h-27

C2v-9

6.65 6.66 13.36 6.65 6.63 6.64 6.69

20.96 20.78 11.00 20.73 20.78 20.88 20.98

6.50 6.495 6.502* 6.50 6.504 6.51 6.504

/3 = 99.3 /3 = 99.62 93,81,108 /3-99.7 (3 = 99.5 /3 = 98.7 /3 = 99.5

12 12 12 12 12 12 12

0.938 0.946 0.935 0.947 0.949 0.940 0.931

6.65

20.80

6.50

/3 = 99.33

12

0.945

12.74 19.08 6.38 19.08 22.03 19.08 11.03 11 6.47 6.54 8.54 5.97

12.74 19.08 6.38 11.01 22.03 19.08 19.08 11 10.71 21.40 9.93 5.97

6.35 6.49 6.33 6.490 6.490 (6.49) 6.49 6.5

0.939 0.922 0.939 0.922 0.922 0.922 0.921 0.92

6.50 42.41 6

12 27 3 18 36 27 18 9 6 12 48

14.5 14.50 14.50

5.8 5.60 11.20

7.4 7.40 7.40

8 8 16

0.898 0.930 0.930 0.898

11.17

5.05 5.06 11.8

5.22

7 ; = 99.07 89,100,99

4

0.85/45

0.854

0.907/112

0.946 0.935 0.88/167

0.947

19.7/82 11.9/370 9.9/1195 5.2/1288 5.5/1331

2*

191

2*4/1

622

2*7/2 2*7/2 2*7/2 2*7/2 Irreg. 2*7/2 2*7/2 2*7/2 2*7/2

125 75

2*4/1 2*4/1 2*4/1 2*4/1 2* 2*3/1 2*3/1?

55 936 894 452 333 67 689 1177 1198 94 8 8 1197 1453 845 1454 990

210

4*12/7

1455

133/71

2*3/1

67

176/10 9.92/82 2*3/1 189/392 7.96/478 2*3/1 186/394 8.8/394 2*3/1 208/676 5.80/676 2*3/1 165/282 10.5/474 2*3/1 178/349 10.0/358 2*3/1 183/380 6.16/182 2*3/1 180/250 7.91/251 2*3/1 220/974 10.9/83 2*3/1 220/975 6.9/1195 186/1003 9.3/1212 147/789 4.22/789 2*3/1 200/975 8.2/1212 2*3/1 170/974 4.0/1404 2*3/1 192/1212 2*3/1 183/1404 2*3/1 2*3/1 2*3/1 3*3/1 2*3/1 2*3/1 cf ref 2*3/1

127 308 170 519 626 131 136 330 991

0.838

6.55

Mono Mono Tri Mono Mono Mono Mono Mono Mono

235/48 228/282 238/632 250/94

Chain conform. (n*p/q) Refs.

0.858/393

161/415 138/545

0.858

160/1459

1.88/545 4*2/1 2.1/1195 4*2/1 8.3/1458 4*2/1 8.0/1459 4*1/1 4*/l 4*

166 485 196 308 308 1456 1457 1642 308 592 1408 943 169 430 1330 409 306 1430 845

References page VI-159

TABLE 1. cont'd Density (g/cm3)

Unit cell parameters Polymer (hi press.) IV. (252.48) -, 3-cyclohexyl1.(124.23)

II. -, 3-cyclopentyl(110.20)

Cryst syst.

Space group

a

b

Tri

Cl-I

5.72

7.64

11.60

Tet

C4-5 or S4-2

21.06

21.06

Rho

C4-3 or C3i-2

19.12

Tet

C4-5 or S4-2

Tet - , hexafluoro(150.02) -, 3-phenyl- [allylbenzene] (118.18)

-, 3-silyl(72.18) -, trimethylsilyl(114.26) Poly(propene-alt-ethylene) syndiotactic (70.14) Mono Poly (1 -tetradecene) 11.(196.38) Ortho

II.

Tet

Poly(vinylcyclopentane) 1.(96.17) Tet II.

Tet

III.

Tet

Poly(vinylcyclopropane) I. (68.12) Rho

b

z

Crystal.

73,89,112

1

0.942

20.09

40

0.926

19.12

6.33

9

0.926

20.34

20.34

47.49

96

0.894

20.30

20.30

47.40

96

0.899

Amorph."

Heat of fusion kj/mola

Chain conform. (n*p/q) Refs.

12*1/1

1460

2*10/3

431

2*3/1

431

2*24/7

431

2*24/7

625

160

2*4/1

268

6.40

230/90 208/187 185/282

2*3/1

67

6.45

128/71

2*3/1

67

6.50

360/71

2*3/1

67

11.62

9.00

7.5

56.0

6.6

9.6 8.57 9.46

9.25 11.20 5.81

5.0 5.04

34.12

34.12

C4h-6

23.4

C4h-6

230/90 215/282 214/328

210/328 225/90

7 = 67.03

55 8

0.94

4 4

1.93 1.758

6.6

64

23.4

6.5

21.99 21.76

21.99 21.76

C4-5 or S4-2

20.48

C4h-6 C4-5 or S4-2 D4h-1 or D4h-7

C3-2 or C3-3 II. Tet S4-2 PoIy(I-vinylene-3-cyclopentylene) [norbornene] trans(94.16) Mono CWMono a

Angles

11.19

Poly(tetrafluoroethylene-aZf-ethylene) (128.07) Mono Ortho Poly(vinylcyclobutane) (82.15) Tet Poly(vinylcycloheptane) (124.23) Tet Poly(vinylcyclohexane) 1.(110.20) Tet Tet

c

Melting point (0C)"

2*4/1

150

267

4*1/1 4*1/1

722 1287 1321

1.14

228/437

2*4/1

431

16

0.927

>300/437

2*4/1

431

6.43 6.50

16 16

0.942 0.951

305/90 300/282 372/441 383/328

2*4/1 2*4/1

431 67

20.48

44.58

96

0.940

2*24/7

431

20.14

20.14

6.50

16

0.969

2*4/7

431

20.14

20.14

19.5

48

0.969

2*12/3

431

37.3

37.3

19.8

0.927

2*10/3

431

13.6

13.6

6.5 6.48

9

0.981

2*3/1

175 526

15.21

15.21

20.85

40

0.938

2*10/3

526

5.13 4.64

4.78 4.22

11.8 11.56 9.84

2 2

1.150 1.749

5*2/ 5*2/1 5*2/1

620 1451 1451

7 = 96

57/250 57/872

1450

1.684

270/441 292/328

230

202 7 = 73.5 7 = 68.1

The numbers after the solidus (/) are reference citations. The unit cell parameter assignment has been changed from that published so as to make c the fiber axis.

TABLE 2. POLY(VINYLS) AND POLY(VINYLIDENES) (-HCH-CHR- and -HCH-RCR-) Density (g/cm3)

Unit cell parameters Polymer

Cryst syst.

Poly(acrylamide) - , WV-dibutyl(183.30)

Hex

Space group

-, N-isopropyl(113.16) Poly(acrylic acid) -, allyl ester (112.13) -, biphenyloxyhexamethylene ester (324.42) Phex -, sec-butyl ester (128.17) Ortho -, tert-butyl ester (128.17) Ortho -, p-carboxyphenyl ester (192.17) Mono -, isobutyl ester (128.17) Ortho -, isopropyl ester isotactic (114.14)

a

b

c

26.3

26.3

6.3

Angles

z

12

Crystal.

Amorph.a

Melting point (°C)a

Heat of fusion kj/mola

0.97 (1.06) 1.118

Chain conform. (n*p/q) Refs.

2*3/1

1.070

6.5

93

200

2*

102

90

2*3/1

278

2*3/1

1122

23.5

23.5

6.48

6

1.043

17.92

10.34

6.49

6

1.062

130

2*3/1

401

17.92

10.50

6.45 6.48

6

1.047

193/16 200

2*3/1 2*3/1

67 401

21.50

7.42

6.68fc

4

1.445

2*

865

17.92

17.92

6.42

12

1.239

81

2*3/1

401

6.5 6.32

162/120 162 178/541

2*3/1

1.08

67 149

5.18

1.18

115

4*1/1

113

4.86/775.23/77 4*1/1 4*1/1 4*1/1 4*1/1 4*1/1 4*1/1 4*1/1 4*1/1

76 486 575 133 162 210 322 1001 1332 1631 804 1631

/3=124

5.9/541

syndiotactic Poly(acrylonitrile) syndiotactic (53.06)

II?

Hex Ortho Ortho Ortho Ortho Ortho Phex Ortho Ortho

C2v-16

C2v-9

Ortho

5.99 21.18 10.6 10.20 18.1 10.55 6.1 21.0 10.7 9.03 21.48 21.18

5.99 11.60 11.6 6.10 6.12 5.80 6.11 11.9 12.1 5.24 11.55 11.71

4.74 11.4 15.08

(5.1) 5.04 5.10 5.00 5.08 (5.1) 5.04 (5.1)

317/77 341/499

16 8 4 8 4 2 16 8

1.125 1.137 1.111 1.273 1.134 1.07 1.119 1.07

7.096

24

1.201

2*4/

4.74 11.4

2.55 8.2

1 16

1.538 1.32

2*1/1 2*4/1

133 1461

15.08

8.54

16

1.151

2*4/1

347

5.02/871 2*5/2 2*5/1 vi ref * 10/1 * 10/1 4*5/2

30 520 868 1002 1462 30

*9/l *30/4

1397 1005

4*37/4

1004

7=120

isotactic Tet (gel) Tet Poly(isopropenylmethyl ketone) (84.12) Tet

240

240/255 200/379 Poly(methacrylic acid) -, methyl ester isotactic (100.12) Port Ortho Ortho Tri Ortho syndiotactic it-st stereocomplex (1:2) Mono -, - , chloroacetone complex syndiotactic Mono

D2h-24

21.08 21.08 20.98 20.57 41.96

21.5

43.5

12.17 12.17 12.06 12.49 24.34

16.5

43.5

10.55 10.50 10.40 10.56 10.50

93,88,91

18.4 73.6

7=112

35.4

7=107

20 20 20 20 80

1.228 1.234 1.264 1.228 1.240

1.22/31

160/31 220/855

1.19/31

200/31

260/1006

References page VI-159

TABLE 2. cont'd Density (g/cm3)

Unit cell parameters Polymer

Cryst syst.

Space group

-, octadecyl ester syndiotactic (338.58) Hex Poly(methacrylontirile) 1.(67.09) Phex II. Mono Poly(thiolacrylic acid) -, sec-b\xty\ ester (144.23) Rho -, isobutyl ester (144.23) Mono -, isopropyl ester (130.20) Rho -, propyl ester (130.20) Mono Poly(vinyl acetate) -, trifluoro(140.06) Ortho Poly(vinyl alcohol) (44.05) Mono Mono Mono

quenched single crystal 12 complex Poly(vinyl bromide) (106.95) Poly(vinyl chloride) (62.50)

single crystal Poly(vinyl fluoride) (46.04)

Poly(vinyl formate) isotactic (72.06)

a

b

4.73

4.73

9.03 7.87 13.5

9.03 8.97 7.71

c

Angles

30.2 6.87 6.87 7.62

(3 = 91.1

z

Crystal.

1

0.961

36

4 4 8

0.918 0.918 1.134

250/436

Chain conform. (n*p/q) Refs.

500 2* 2*4/1

427 729 427

6.35

2*3/1

401

Cs-2

6.42

2*

401

C3-2

6.42

2*

401

Cs-2

6.4

2*3/1

401

2*

638

9.54

12.44

4.8

4

1.633 1.350 1.34/410 1.350 1.345 1.352 1.343 1.490 1.133

7.81 7.81 7.805

5.51 5.43 5.485

2.52*

7-91.7 7 = 91.5 2.533* 7 - 92.2

2 2 2

Mono Mono Ortho Hex Mono

C2h-2

7.81 7.84 7.42 5.45 7.87

5.50 5.52 5.25 5.45 5.53

2.52* 7 = 92 2.52* 7 = 93 2.52* 2.51 2.525* 7 = 93.3

2 2 2 1 2

Ortho

D2h-ll

11.0

5.6

5.1

4

2.26

Ortho Ortho Ortho Mono Ortho

D2h-ll D2h-ll

10.6 10.40 10.11 10.65 10.24

5.4 5.30 5.27 5.20 5.24

5.1 5.10 5.12 5.15* 5.08

4 4 4 4 4

1.42 1.477 1.522 1.456 1.523

4.93 4.95 4.938

2.53 2.52 2.518

1 2 1

1.436 1.430 1.4377

18

1.502

Rho

Heat of fusion kj/mola

C3-2

C2h-2

Hex Ortho Mono

Amorph.a

Melting point (°C)a

C2v-20

D2h-ll

C2v-14

C3v-6D3d-6

4.93 8.57 4.938

15.9

15.9

7 = 90

y = 120

6.55

175/821 1.291/1 1.27/410 1.26/53 1.269

232/310 243/480 265/323 228/433 267/450

6.87/433 2*1/1 6.99/480 2*1/1 7.1/1195 2*1/1

117 1.41/413

2*1/1 2*1/1 2*1/1 2*1/1 2*1/1

29 316 132 184 261 1441 261 151 1424

4*1/1

772

273/372 310/423 212/143

11/372 4.9/835 2.8/145 3.3/423

4*1/1 4*1/1 4*1/1 4*1/1 4*1/1

7 235 64 140 718

200/79 230/434

7.54/79

2*1/1 2*1/1 2*1/1

62 236 1463

2*3/1

232

4*1/1

232

syndiotactic 5.0 Poly(vinylidene bromide) (185.85) Mono Poly(vinylidene chloride) (96.94) Mono Mono Mono Mono

C2h-2

C2-2

25.88

13.87

4.77*

7=109.8

16

3.065

6.71 13.69 22.54 6.73

12.51 6.296 12.53 12.54

4.68* 4.67* 4.68* 4.68*

7=123 7=124.8 7 = 95.8 7=123.6

4 4 16 4

1.954 1.948 1.958 1.957

33 1.66/43

200/721 190/46 195

4*1/1 4*1/1 5.68 2*2/1

1.7754 Poly(vinylidene fluoride) a (II) Mono (64.04) Ortho Mono Ortho Mono Mono

C2v-4 C2-2 C2v-9 C2h-5 C2-2,l

5.02 4.96 17.72 9.66 4.96 9.64

25.4 9.64 11.68 4.96 9.64 5.02

4.62 4.62 4.57* 4.64 4.62 4.64*

/3=107 7 = 92.7 /3 = 90 7 = 91.1

10 4 16 4 4 4

1.888 1.925 1.801 1.913 1.925 1.895

1.68/776 1.67/770

185/434 170/995 220/443 171/373 178 178/726

6.7/823 6.2/886 4*1/1 5.96/726 4*1/1 2*2/1 4*1/1 4*1/1

915 32 33 245 231 462 171 994 417 418 604 168

TABLE 2. cont'd Density (g/cm3)

Unit cell parameters Polymer

P(I)

Y (HI)

Cryst syst.

Space group

Port Ortho

C2-2

Ortho Ortho Ortho Ortho Mono Mono Ortho Mono

C2v-14 C2v-14 C2v-14

8(IV) (polar alpha) Ortho Poly(vinylmethyl ketone) (70.09) Tet Tet

Cs-4 C2-3 C2v-16

C2v-9 S4-1

a

b

c

5.02 9.60 9.80 8.45 8.58 8.47 8.60 4.96 8.66 4.97 4.96 4.96 4.96

9.63 5.00 5.05 4.88 4.91 4.90 4.97 9.58 4.93 9.66 9.67 9.64 9.64

4.62 4.655

14.52 14.56

14.52 14.56

Chain conform. (n*p/q) Refs.

Crystal.

4 4 4 2 2 2 2 8 2 8 8

1.904 1.904

188/846 213/1464

2*2/1

2.022 1.972 2.002 1.936 1.942 1.945 1.930 1.930

212/443 191 207/942

2*1/1 2*1/1 2*1/1

218/846 197 184/995 231/1464

4.62

4

1.925

8*1/1 2*1/1 8*1/1 8*1/1 4*1/1 4*1/1

563 597 750 417 604 418 597 996 604 997 998 999 1000

14.40 14.10

28 28

1.073 1.090

2*7/2 2*7/2

164 379

/3 = 92.9 /3 = 91 /3 = 93

Amorph.*

Heat of fusion kj/mola

z

2.55 2.56 2.56 2.57 9.23 2.58 9.18 9.20

Angles

Melting point (°C)a

170

a The numbers after the solidus (/) are reference citations. * The unit cell parameter assignment has been changed from that published so as to make c the fiber axis.

TABLE 3.

POLY(AROMATICS) AND POLY(IMIDES) Density (g/cm3)

Unit cell parameters Polymer

Cryst syst.

Space group

a

b

Poly(4,4 '-benzobisthiazole-diphenylene pyromellitimide) (556.57) Ortho D2-3 5.70 8.11 Poly(2,6-benzothiazole) (133.17) Port 6.044 3.417 Poly(2,5(6)-benzoxazole) (117.11) Port 6.061 3.384 Poly(4,4 '-biphenylene 3,3' ,4,4 '-biphenylenetetracarboximide) (442.43) - , 2,2'-bis(trifluoromethyl)(578.43) Mono 15.40 9.90 Mono 15.40 9.918 -, 2,2'-dimethyl(470.48) Tri 20.49 15.30 - , 3,3'-dimethyl(470.48) Ortho 16.7 13.0 Poly(4,4 '-biphenylene 4,4 '-carbonyl(3,3 ;-dicarboxy)-dibenzamide) (506.47) Poly(4,4 '-biphenylene 3,3 ',4,4'-carbonyldiphenylenetetracarboximide) (470.44) Poly(4,4'-biphenylenedioxy-3,3 '-biphenylene pyromellitimide) (550.53) Ortho 7.89 6.29 Ortho 7.85 6.37 Poly[2,2 '-(4,4 '-biphenylene) 6,6 '-diquinoline] -, di-/?-phenyl(558.63) Ortho 16.2 5.31 Poly(4,4'-biphenylene 4,4'-oxy(3,3 '-dicarboxy)-dibenzamide) (494.46) Poly(4,4 '-biphenylene 3,3 ',4,4 '-oxydiphenylenetetracarboximide) (458.43) Poly(4,4 '-biphenylene 1,4-pyromellitamide) (402.36) Poly(4,4 '-biphenylene pyromellitimide) (366.33) 8.58 5.48 Ortho D2h-9 8.57 5.51

c

Angles

Amorph.a

Melting point (0C)a

Heat of fusion kj/mola

Chain conform. (n*p/q) Refs.

z

Crystal.

24.8

2

1.612

22*1/1

1433

12.19

2

1.756

5*2/1

1235

11.58

2

1.638

5*2/1

1235

1.480 20.25 20.21

7 = 56 7 = 56.2

4 4

1.501 1.4977

40.0

62,52,80

16

1.443

8

1.404

1335 18*1/1 18*1/1

1494 1495

18*2/1

1584

18*1/1

1289

21.2

21*1/1

1178

21.6

19*1/1

1178

23*1/1 34*1/1

1475 1498

20*1/1

1500

21*1/1

1178

19*1/1

1178

16*1/1

1178

15*1/1 15*1/1

908 928 1476

20.5

25.11 25.31

2 2

1.467 1.444

21.4

2

1.008

1.341

388

21.0 21.3

900/1018

16.1 16.6 16.6 16.78

2 2

1.559 1.535

827/1018

References page VI-159

TABLE 3. cont'd Density (g/cm3)

Unit cell parameters Polymer

Cryst syst.

Space group

a

b

Poly(2,2 '-bithiophene) -, 3,3'didecyl(444.78) Ortho 17.6 4.5 -, 3,3'-dihexyl(332.56) Ortho 11.8 4.5 -, 3,3'-dioctyl(388.67) Mono C2h-4 14.6 4.42 Ortho 14.5 4.5 Ortho 14.6 4.42 Poly(4,4 '-carbonyldiphenylene pyromellitimide) (394.34) Ortho 7.9 6.65 Poly(decamethylene 3,3 ',4,4'-oxydiphenylenetetracarboximide) (446.50) Poly(decamethylene pyromellitimide) (354.40) Mono 19.8 4.61

c

Amorph.a

Heat of fusion kj/mola

Chain conform. (n*p/q) Refs.

z

Crystal.

15.6

2

1.20

6*2/1

1485

15.6*

2

1.33

6*2/1

1485

2 2 2

1.36 1.27 1.27

6*2/1 6*2/1 6*2/1

1484 1485 1486

4

1.520

16*2/1

908 1013

21*1/1

896

14.73 15.6* 15.70

Angles

Melting point (°C)a

/3 = 90

31.0fe 32.8 23.5 19.2

7 = 96

4

1.350

318 323/1267

17*1/1

1395

19.1

90,111,100

1

1.409

308

20*1/1

1015

18.9 7=108.4 1 18.96 Mono 18.95 4.54 21.5 7=101.3 4 21.43 Y 22.05 5 20.95 Poly(3,4 '-ethylenedioxydiethylenedioxydiphenylene 3,3 ',4,4 '-oxydiphenylenetetracarboximide) (606.59) Poly(3,4'-ethylenedioxydiphenylene 3,3 ',4,4'-oxydiphenylenetetracarboximide) (518.48) Poly(2,7-fluorenylene 1,4-pyromellitamide) (414.37) 15.9 Poly(2,7-fluoenylene pyromellitimide) (378.34) 16.3 Poly(hexamethylene 3,3 ',4,4'-oxydiphenylenetetracarboximide) (390.40) 19.5 Tri 8.34 9.18 19.6 90,134,117 2 Poly(hexamethylene pyromellitimide) (298.30) 24.88 Poly[4,4 '-(isophthaloyldiamino)-diphenylene 3,3 ',4,4 '-oxydiphenylenetetracarboximide] (620.58) Ortho 9.84 4.95 28.5 2 Poly [4,4' -(isophthaloyldiamino)-diphenylene /7-phenyleneditrimellitatediimide] (768.69) Ortho 6.03 7.58 73.6 4 Poly[4,4 '-(isophthaloyldiamino)-diphenylene pyromellitimide] (528.48) 24.2

1.289

19*1/1

1395 1371 1015 1371 1371 1371

Poly(dodecamethylene (432.52) Poly(dodecamethylene a (382.46) P

1,4,5,8-naphthalenetetracarboximide) Tri 6.23 pyromellitimide) Mono 5.58

4.68 4.89

1.401

(1.462)

297 305/1267

19*1/1

268

88.0

1493

340

72.5

1493

238

15*1/1

1178

14*1/1

1178

17*1/1

896 1015

430 1.485

320

1.518

1395 26*1/1

1190

33*2/1

1191

22*1/1

1191 1335

34*1/1

1498

16*2/1

908 1013 1014

1.382 Poly[isophthaloy 1-4,4 '-diphenylenedioxy-4,4 '-diphenylene 3,3 ',4,4'-carbonyldiphenylenetetracarboximide] (786.75) Ortho 8.07 6.135 37.50 2 1.07 Poly(4,4 '-methylenediphenylene pyromellitimide) (380.36) 29.1 Ortho 8.20 6.55 32.4 4 1.452 14.1 Poly(methylene-/?-phenylene) (90.12) Ortho 8.16 6.32 9.90 4 1.172 - , oc-methyl(104.15) Ortho 10.42 Poly (methy lene-3,5 -toluene) - , 2,6-diamino(134.18) Ortho 12.82 Poly(2,6-naphthalene 2,4-cyclobutylenedicarboxylic acid) - , bis(2,4-dichlorophenyl) ester (558.24) Tri Ci-I 6.00

350

170 142/744

5*2/1

745

219/1007

5*2/1

848

5.97

9.62

4

1.156

13.83

9.69

8

1.037

4*2/1

1351

8.93

13.48

1

1.396

9*1/1

950

70,94,101

TABLE 3. cont'd Density (g/cm3)

Unit cell parameters Polymer

Cryst syst.

Space group

a

be

Angles

Poly(4,4 '-neopentylenedioxydiphenylene 3,3 ',4,4 '-carbonyldiphenylenetetracarboximide) (572.57) Mono 9.60 5.82 24.6 7 = 81.1 Poly(nonamethylene 3,3 ',4,4'-oxydiphenylenetetracarboximide) (432.48) 21.3 Poly(nonamethylene pyromellitimide) (340.38) 32.0 Poly(octamethylene 3,3 ',4,4 '-oxydiphenylenetetracarboximide) (418.45) Tri 8.37 4.95 Tri 8.37 4.95 Poly(octamethylene pyromellitimide) (326.35) Mono 20.8 4.76

z

Crystal.

2

1.400

Amorph."

Melting point (°C)a

Heat of fusion kj/mola

Chain conform. (n*p/q) Refs.

24*1/1

1499

20*1/1

1015

303 >350

1395 1267 19*1/1

21.5 21.5

90,38,104 90,38,104

1 1

1.372 1.396

16.9

7 = 95.5

4

1.301

Poly(3,4'-oxydiethylenedioxdiphenylene 3,3 ',4,4'-oxydiphenylenetetracarboximide) (562.34) Poly(3,4 '-oxydiphenylene 3,3',4,4'-biphenylenetetracarboximide) (458.43) Mono 14.8 8.20 20.6 7 = 56 Poly [4,4 '"-((4 ',4 "-oxydiphenylene)-dioxy)-diphenylene /?-phenyleneditrimellitatediimide] (806.74) 5.68 8.09 78.6 Poly[4,4 '"-((4 ',4 "-oxydiphenylene)-dioxy)-diphenylene pyromellitimide] (566.53) 8.44 5.66 53.4 53.4 Poly(4,4 '-oxydiphenylene 3,3 ',4,4'-oxydiphenylenetetracarboximide) (474.43) Mono 5.17 10.85 38.2 7=103.7 Poly[4,4'-oxydiphenylene 3,3 '-(/?-phenylene)-ditrimellitatediamide] (658.58) 26.3 Poly(4,4 '-oxydiphenylene p-phenyleneditrimellitatediimide) A. (622.54) Mono 5.56 7.94 58.0 7 = 86 5.56 7.94 59.0 /3 = 86 28.7

1.30 202

19*1/1

896 1015

362 383/1267

15*1/1

1395

304

80.2

1493

4

1.469

18*1/1

1289

4

1.484

37*2/1

963

4

1.475

547/1018

26*2/1

963 908

4

1.514

427/1018

20*2/1

684

26*2/1

1178

27*2/1 27*2/1

658 963 1178 1335 963

4 4

1.619 1.591

8

1.410

1.366 B. Poly (4,4' -oxydiphenylene 1,4-pyromellitamide) (418.36)

13.12

7.84

57.0

27*2/1

15.2

17*1/1

1178 1335

15*2/1 15*2/1

1477 1478

16*2/1 16*2/1

642 684 877 1477 1478 1178 1477

1.410 Poly(3,4 '-oxydiphenylene pyromellitimide) (382.33) Ortho Ortho D2-9 Poly(4,4 '-oxydiphenylene pyromellitimide) 1.(382.33) Ortho Ortho Ortho C2-2 Ortho Mono C2-2 II. Poly(m-phenylene) (76.10) Poly(/7-phenylene) (76.10)

- , complex with: K (l/2K/unit) SbCl5 (l/2Sb/unit) SbF5 (l/3Sb/unit)

Ortho

8.48 5.75

5.62 8.48

33.65 33.2

4 4

1.583 1.569

6.35 6.31 4.66 8.36 6.45

4.05 3.97 5.96 5.63 4.01

2 2 2 4 2

1.514 1.58 1.411 1.633 1.507

5.93

4.70

32.6 32 32.9* 33.03 32.58 15.9 33.00

2

1.380

7 = 100 7 = 90

597/1018

16*2/1 16*2/1 16*2/1 790/964

Ortho Ortho Mono Ortho Ortho

pgg

7.81 7.80 8.06 7.82 7.79

Ortho

D2h-9

6.04

5.53 5.56 5.55 5.60 5.51

4.20 4.20 4.30 4.20 (4.20)

/3=100

2 2 2 2 2

1.393 1.388 1.334 1.374 1.402

6.90/964 3*

320/228

2*3/1 2*3/1 2*3/1 2*3/1 2*3/1

126 825 1010 607 813

360/75

2*4/1

122

2*3/1

185 861

425/142 30.2/82 6*2/1 420/219 6*1/1 375/82 6*1/1 435/1187 6*1/1

223 426 595 1181

1.208

212

/3=102.5 /3=134.7 /3=135

1.05

400/395 440/546 P

- , chloro(138.60) -, ethyl(132.21) - , isopropyl(146.23) a b

Mono Rho Hex

8.10 20.52 20.52

5.25 20.52 20.52

6.53 6.55 6.58 6.55

/3 = 95

Tri Mono

5.92 5.9

12.8 12.8

6.55 6.55

Mono

5.9

13.4

Mono

5.9

14.1

C3-1

2 16 16

1.250 1.158 1.153

90,90,135 /3=135

2 2

1.312 1.32

6.55

/3=135

2

1.20

6.55

/3=135

2

1.26

6*1/1 6*1/1 6*1/1

223 1011 426 224

290/395

6*1/1 6*1/1

1012 1181

170/395

6*1/1

1181

6*1/1

1181

420 412

The number after the solidus (/) are reference citations. The unit cell parameter assignment has been changed from that published so as to make c the fiber axis.

References page VI-159

TABLE 4. POLY(DIENES) AND POLY(DIYNES) Density (g/cm3)

Unit cell parameters Polymer

Cryst syst.

1,4-Poly(2,3-azabutadiene) - , 1,4-diethyltrans(112.18) 1,2-Poly( 1,3-butadiene) syndiotactic (54.09) Ortho isotactic Rho 1,4-Poly( 1,3-butadiene) transI. Phex (54.09) Mono

Space group

a

b

c

Angles

z

Crystal.

Amorph.fl

Heat of fusion kj/molfl

4.72

D2h-ll

10.98

D3d-6

17.3

C2h-5

6.60 17.3

Phex Hex

Chain conform. (n*p/q) Refs.

4*1/1

1504

5.14

4

0.964

154

4*1/1

7

6.5

18

0.96

120

2*3/1

12

1 4

1.03 1.036

1 1

0.930 0.908

100/352 96/451 55/624 141/352 148/44 145/451 142/624

10.0/352 4*1/1 13.8/4514*1/1 6.31/624 4.61/352 4*1/1 5.99/342 4*1/1 4.61/451 3.62/624

37 496 1195 154 550

8 4

0.821 1.011

6.3/335 1 12/1121

9.2/353 8*1/1

60 124 1195

4*11/3

367

4.54 8.63

4.54 9.11

4.9 4.83

4.88 4.95

4.88 4.95

4.68 4.66

8.53 4.60

8.16 9.50

12.66 8.60

/3=114

0.891 II. (>65°C)

Melting point (0C)"

cisMono Mono or - , 2-tert-butylcis(110.20) Tri - , chlorinated c/s-threo-disyndiotactic (125.00) Mono ?ra«s-erythro-diisotactic Mono - , 2-chloro- [chloroprene] trans(88.54) Ortho Ortho cis-

C2h-5 Cs-4 C2h-6

/2 = 83.33 /3=109

0.902

13.95

20.78

15.3

C2h-4

7.37

5.30

10.10

C2h-5

7.05

8.05

5.10

D2-4

8.84 9.0

10.24 8.23

4.79 4.79

22

0.908

106

/3=134

2

1.463

4*2/1

768

/3=100

2

1.456

4*1/1

768

4 4

1.356 1.658

4*1/1 4*1/1

40 109

4*1/1

275

4*1/1 4*1/1

221 565 699

115/229 80/81

8.37/81

70/1157 - , 1-cyano trans(79.10) - , 2,3-dichlorotransI. (122.98) Mono II. Ortho - , - , thiourea complex Mono Mono - , 2,3-dimethyltrans(82.15) Ortho cis-

4.8

C2h-5 C2v-9

5.34 8.81

9.95 12.34

4.86 4.80 4.80

/3 = 93.5

C2Hh5 C2h-5

9.87 9.91

15.83 15.85

12.53 12.5

/3=114.1 /3=114.1

C2v-9

9.13

13.00

4.35 4.70

2 4

1.604 1.565 1.44 1.44

4

565 803

260 272/221

0.978

7.0 - , - , thiourea complex Mono - , 2-methyl- [isoprene] transot (68.12) Mono

C2h-5

10.40

15.47

12.5

C2h-5

7.98

6.29

8.70 8.76 8.77

D2-4

7.78 7.85

11.78 11.9

4.72 4.8*

4*1/1

198 /3=114.4

(3 = 102

220

1.22

4

1.051

4 4

1.046 1.009

803

80/1121

13/1121 4*2/1 10/1128

65/46 64/81

8.0/1128 4*1/1 10.6/287 4*1/1

0.905 P(LM)

Ortho Ortho

104 699

288 502 715 1127 40 288

TABLE 4.

cont'd Density (g/cm3)

Unit cell parameters Polymer

Cryst syst.

Space group

Ortho

a

b

7.83

11.87

c

Angles

4.75

z

Crystal.

4

1.025

Amorph.a

0.906

8(HM)

Mono

e cisMono

C2h-5

Ortho Mono Ortho

D2h-15

-, -, 3-chlorotrans(102.56) -, - , hydrochlorinated (104.58) Port C2h-5 Ortho -, 2-methylacetoxytrans(126.15) Ortho -, perhydrotriphenylene complex trans2 phtp/monomer Hex C6h-2 cis-, 2-propyltrans(96.17)

5.9 7.84

7.9 5.99

9.2

7 = 94

4 4

1.06

7.80

6.29

12.46 25.2

8.89 8.97

8.10 8.20*

/3 = 92

8 16

1.009 0.976

26.3 12.4

8.9 8.9

8.15* 8.15*

7=109.5

16 8

1.01 1.101

Melting point (°C)a

Heat of fusion kj/mola

82/287 78/630 78/568 80/1170 74/81 80/287 87/568 89/1170

12.7/81

Chain conform. (n*p/q) Refs. 4*1/1

502 1195

4*2/1

502 492

492 0.906/53 0.910/47

28/81 36/50 14/287 36/1169

4.9 5.83 11.9

10.38 10.4

8.95 9.1*

16.2

9.3

14.26

/3 = 90

4.40/81 8*1/1 4.6/1195 8*1/1 8*1/1

40 288 124 1019 1019

4*1/1

165

4 8

1.282 1.23

115 110

4*2/1 4*2/1

229 70

4.75

4

1.17

135

4*1/1

165

14.26

4.78

1

1.079

183/1124

10.95

6.65

9.2

4

0.95

42 42/368

8.22

8.22

11.01

23.12 20.8

7.87 8.0

9.69 9.7

13.25

7.63

9.17

9.92

5.33 53.86

54.36 10.98

4.88 4.880

18.30 18.13 19.93 18.9

10.78 10.81 9.58 10.89

4.89* 4.89* 4.83* 4.83*

7= 7= 7= 7=

39.03 39.16 6.11 6.02

798

8*1/1

368

- , urea complex Hex D6-2 1,4-Poly( 1,3-butadiyne) - , 1,4-(4,4 '-diphenyleneglutarate)(330.34) Mono C2h-6 Mono C2h-6 Poly(chloroprene), see Poly(butadiene), 2-chloro1,12-PoIy(U 1-dodecadiyne) macromonomer Mono C2h-5 (160.26) cross-polymer Mono C2h-5 5,8-Poly(5,7-dodecadiynediol) - , l,12-bisOV-butoxycarbonyl)methylurethane(508.61) Ortho D2-3 -,1,12-bis(ethylurethane)(336.43) Mono C2h-5 Mono (hi temp) Mono C2h-5 Mono -,1,12-bis(phenylurethane)(432.52) Mono C2h-5 Mono C2h-5 -, l,12-bis(p-toluylsulfonyl)(502.64) Tri Ci-I (HOK) Tri Ci-I 10,13-Poly(10,12-heptacosadiynoic acid) (as Li salt) (400.65)

6.229 6.205 20.13 20.01 65

827

/3 = 111.29 /3=106

4 4

1.336 1.41

4*2/1 4*2/1

948 913

14.15*

7=118.5

4

0.847

12*1/1

12.2

7=123.5

4

1.146

2 4

1.195 1.170

4*1/1 4*1/1

1319 1329

95 94 91 91

2 2 2 2

1.163 1.169 1.212 1.124

4*1/1 4*1/1 4*1/1 4*1/1

1318 1320 1318 1320

4.909 4.90*

/3=106.85 /3=106.42

2 2

1.258 1.259

4*1/1 4*1/1

95 1353

4.91 4.91

95,94,89 95,94,89

1 1

1.391 1.420

4*1/1 4*1/1

381 381

1022 1022

1268

References page VI-159

TABLE 4. cont'd Density (g/cm3)

Unit cell parameters Polymer

Cryst syst.

1,4-PoIy(1,3-heptadiene) transisotactic (96.17) Mono - , 6-methyltransisotactic (110.20) 1,4-PoIy (1,3-hexadiene) transisotactic (82.15) Ortho --, 5-methyltransisotactic (96.17) 2,5-Poly(2,4-hexadiene) frajw-erythro-diisotactic (82.15) - , 2,5-dimethyltrans(110.20)

Space group

a

b

c

Angles

z

Crystal.

C2-2

8.62

7.95

4.85

/9 = 99

2

0.973

2,5-Poly(2,4-hexadienedioic acid) tazns-erythro-diisotactic - , diisopropyl ester (226.27) Ortho 2,5-Poly(2,4-hexadienoic acid) /rans-erythro-diisotactic - , 6-amino0.5 CdCl4/unit Tri Ci-I (254.25) Tri Ci-I - , - , hydrochloride (163.60) - , butyl ester (168.24) Ortho - , ethyl ester (140.18) - , isoamyl ester (182.26) - , isobutyl ester (168.24) - , isopropyl ester (154.21) - , methyl ester (126.16) frans-threo-diisotactic -methyl ester (126.16) 2,5-Poly(2,4-hexadiyne) - , l,6-di(AT-carbazoyl)(408.50) Mono Mono Mono - , - , hexabromoMono 2,5-Poly(2,4-hexadiynediol) (50mrad) Mono (" annld) Mono (110.11) Mono - , l,6-bis(ethylurethane)(252.27) Mono

C2h-5 C2h-5 C2h-5

C2h-5 C2h-5

C2h-5

14.02

14.16

9.67* 7.214

8.02

Heat of fusion kj/molfl

Chain conform. (n*p/q) Refs.

85/371

4*1/1

375

119

4*1/1

371

82/371

4*1/1

274

4.85

88

4*1/1

371

2.3

84

2*1/1

525

4.8

265 265/376

4*1/1

183

4.85

D2-4

Amorph."

Melting point (°C)a

4.85

10.28

9.70

10.70 7.245

17.79 18.59

4

93,90,90 104,97,96

1.000

4

1.064

230/420

8*1/1

420

8 4

1.838 1.823

347

4*2/1 8*1/1

1123 1188

334 11.36

9.70

4.80

2

4*1/1

384

4.80

4*1/1

384

4.80

4*1/1

384

4.80

4*1/1

384

4.80

4*1/1

384

4.80 4.8

4*1/1 4*1/1

384 1208

9.4

4*2/1

1208

4*1/1 4*1/1 4*1/1

951 611 830

4*1/1

1503

13.03 12.82 12.87

17.55 17.33 17.40

4.92* 4.886* 4.907*

7=108.7 7=108.3 7 = 108.3

14.21

20.67

4.75*

7=106.8

15.78 16.05 16.09

4.703 4.819 4.793

/3=110.34 /3=106.08 /3=106.4

2 2 2

1.258 1.196 1.203

4*1/1 4*1/1 4*1/1

903 903 904

17.96

4.88

7 = 98.42

4

1.277

4*1/1

1240

4.176 4.115 4.109 15.14

2 2 2

1.056

1123

1.273 1.316 1.300

TABLE 4. cont'd Density (g/cm3)

Unit cell parameters Polymer

Cryst syst.

Space group

- , l,6-bis(phenylsulfonyl)- , - , di-/?-fluoro(426.41) Mono C2h-5 Mono C2h-5 Mono C2h-5 - , - , di-/?-methoxy(450.48) Tri Ci-I - , l,6-bis(phenylurethane)1.(348.36) Tri Ci-I (5 dioxane/unit) II. III. - , 1,6-bis-(/?-toluylsulfonyl)1.(418.48) Mono C2h-5 Mono C2h-5 Mono C2h-5 II. (120K) Mono C2h-5 - , 1 -(p-toluylsulfonyl)-6-(/7-fluorophenylsulfonyl)1.(422.44) Mono II. (143K) Mono Poly(isoprene), see Poly(butadiene), 2-methyl10, 13-Poly(10,12-nonacosadiynoic acid) (as Li salt) Ortho (428.70) 1,9-Poly( 1,8-nonadiyne) macromonomer Mono C2-2 (118.18) cross-polymer Mono C2h-5 1,4-PoIy (1,3-octadiene) transisotactic (110.20) 2,5-Poly(2,4,6-octatriynediol) (134.14) Mono C2h-5 - , l,8-bis(phenylurethane)(372.38) Mono C2h-5 10,13-Poly(10,12-pentacosadiynoic acid) (as Li salt) (372.59) 1,2-PoIy (1,3-pentadiene) transsyndiotactic (68.12) - , 4-methylisotactic II. Tet D2d-10 (82.15) syndiotactic I. II. 1,4-Poly( 1,3-pentadiene) transisotactic (68.12) Ortho Ortho D2-4 cisisotactic Ortho D2-4

a

b

13.93 13.89 13.96

14.06 14.10 14.10

12.72 16.78

8.543 12.53

Melting point (°C)a

Heat of fusion kj/mola

Chain conform. (n*p/q) Refs.

— Angles

z

Crystal.

4.90* 4.91* 4.914*

7=113.3 7=113.2 7 = 113.56

2 2 2

1.606 1.602 1.597

4*1/1 4*1/1 4*1/1

1378 1379 1380

4.902*

110,103,79

1

1.542

4*1/1

1021

4.89* 4.9 4.9 4.9

84,83,69

2

1.340

4*1/1 4*1/1 4*1/1

716 749 749 749

35/1020 4*1/1 4*1/1 4*1/1 4*1/1

898 1277 1381 899

c

Amorph."

14.49 14.53 14.91 14.93

14.94 14.96 14.48 25.56

4.910* 4.912* 4.93 4.910*

7 =118.14 7=118.21 7=118.0 7 = 92

2 2 2 4

1.482 1.477 1.479 1.484

14.22 14.10

14.52 14.43

4.909* 4.906*

7=116.1 7=116.3

2 2

1.541 1.566

4*1/1 4*1/1

1337 1337

4

1.04

4*1/1

1268

7 = 90.8

4

0.837

9*2/1

1023

/9=101.71

4

1.016

9*2/1

1023

4*1/1

371

70

7.88 9.30

8.11

4.89

5.67

21.00*

17.5

4.85

4.85

102/1020

87

4.11

19.59

4.80

(3 = 109

2

1.219

4*1/1

780

24.65

30.74

4.89

(3 = 92.2

8

1.336

4*1/1

780

60

1268

5.1

17.80

17.80

36.50

72

0.849

10

4*1/1

230

167/707

2*18/5

488

12*1/1 4*1/1

1502 1502

11.73 5.05

19.73 19.80

4.85 4.86

4.8 4.85

4 4

0.98 0.969

9.47

5.97

8.15 8.15

4

0.982

95 104/1126

4*1/1 4*1/1

189 200

44

4*2/1 4*2/1

844 263

53

8*1/1 8*1/1

1431 234

syndiotactic Mono

C2h-5

6.34

9.12

8.50 8.50

/3=

105.9

4

0.957

References page VI-159

TABLE 4. cont'd Density (g/cm3)

Unit cell parameters Polymer - , 2-methyltransisotactic (RT) (82.15) (153K) cisisotactic a (-130) P(RT)

Cryst syst.

Space group

a

Mono

C2h-5

Mono

Ortho Ortho

b

c

12.89

9.186

C2h-5

12.78

9.084

D2h-15 D2-4

10.74 9.30

- , 3-methylcisisotactic (82.15)1. II. syndiotactic II. 1,4-PoIy (1,3-pentadiynol) - , 1-N-carbazoly(245.28) Mono C2h-5 2,5-Poly(5-phenyl-2,4-pentadienoic acid) frans-erythro-diisotactic - , butyl ester (230.31) -methyl ester (188.23) 1,24-Poly( 1,11,13,23-tetracostetrayne) cross-polymer Mono C2h-4 (322.54)

16.49

26.8*

13.04 7.73

19.51

8.254

Angles

z

Crystal.

4.820* /3 = 93.5

4

0.958

4.824* /3 = 93.6

4

0.977

7.87 7.90

8 4

0.990 0.961

Amorph."

Melting point (°C)a

Heat of fusion kj/mola

4*1/1

1317

4*1/1

1317

4*2/1 4*2/1

1364 1364

8.02 6.97

*2/l *3/l

1497 1497

8.6

8*1/1

1501

4*1/1

1354

4.80

4*1/1

384

4.80

4*1/1

384

4.873* 7=124.27

4.91*

7=119.6

4

2

195/1365

Chain conform. (n*p/q) Refs.

175 165 165/1365

1.257

1.136

1264

a

The number after the solidus (/) are reference citations. * The unit cell parameter assignment has been changed from that published so as to make c the fiber axis.

TABLE 5.

POLY(PEPTIDES) -(NH-CHR-COK Density (g/cm3)

Unit cell parameters Polymer Poly(L-alanine) a helix (71.08) P - , phenyla helix (147.18) co helix

Cryst syst.

Space group

a

b

hex

8.55

8.55

Ortho Ortho

4.79 4.734

10.7 10.54

Hex

11.55

11.55

Tet 11.28 Tet 12.86 Poly(p-alanine), see Poly(3-aminopropionic acid) Poly(L-alanyl-D-alanyl-L-alanyl-D-valine) (312.37) Ortho 9.5 Poly(L-alanyl-L-alanylglycine) (200.22) Ortho 9.44 -phenyl- [2nd alanyl] (275.31) Poly(L-alanyl-L-alanylglycyl-L-prolyl-L-prolylglycine) (450.49) Ortho 10.5 Poly(L-alanyl-D-alanyl-L-valyl-D-valine) (340.42) Ortho 9.5

11.28 12.86

31.0 9.96

34.1

c

70.3 6.88 6.89

5.91 5.59

Angles

z

Crystal.

Amorph.a

Melting point (°C)a

Heat of fusion kj/mola

Chain conform. (n*p/q) Refs.

47

1.246

3*47/13

507

4 4

1.339 1.373

3*2/1 3*2/1

507 509

3*18/5

1025

4 4

1.300 1.057

3*4/1 3*4/1

1024 1025

11.0

8

1.281

12*1/1

1046

20.94*

8

1.351

9*2/1

753

15

9*

774

29.5

18*

755

11.0

8

1.269

12*1/1

1046

TABLE 5. cont'd Density (g/cm3)

Unit cell parameters Polymer

Cryst syst.

Space group

a

b

c

Angles

z

Crystal.

Poly(L-alanyl-4-aminobutyric acid) (156.18) Ortho 9.4 9.9 9.2 4 1.21 Poly(L-alanyl-6-aminocaproic acid) (184.24) Ortho 9.4 9.8 11.5* 4 1.16 Poly(L-alanyl-3-aminopropionic acid) (142.16) Ortho 9.4 9.8 16.1* 8 1.27 Poly(L-alanyl-l 1-aminoundecanoic acid) (254.37) Ortho D2-5 4.79 10.35 29.8 4 1.144 Poly(L-alanyl-5-aminovaleric acid) (170.21) Ortho 9.4 10.7 20.7* 8 1.09 Poly(L-alanyl-L-glutamylglycine) - , y-ethyl(285.30) Mono 9.54 8.54 21.36* 7 = 106 4 1.133 Poly(L-alanylglycine) 1.(128.13) Ortho 9.42 8.87 6.95* 4 1.466 Ortho 9.44 8.96 6.94* 4 1.450 II. Ortho 4.72 14.4 9.6 4 1.30 Poly(L-alanylglycyl-L-alanylglycyl-L-alanylglycyl-L-alanylglycyl-L-alanylglycyl-L-alanylglycyl-L-glutamylglycine) (990.98) Ortho 9.64 9.62 48.65 4 1.459 Poly(L-alanylglycyl-L-alanylglyclyl-L-alanylglycyl-L-alanylglycyl-L-alanylglycyl-L-glutamylglycine) (850.84) Ortho 9.57 9.70 41.70 4 1.460 Poly(L-alanylglycyl-L-alanylglycyl-L-alanylglycyl-L-alanylglycyl-L-glutamylglycine) (710.70) Ortho 9.48 10.28 34.75 4 1.394 Poly(L-alanylglycyl-L-alanylglycyl-L-alanylglycyl-L-glutamylglycine) 1.(570.56) Ortho 9.48 17.34 18.8 4 1.226 II. Ortho 9.48 10.60 27.80 4 1.356 Poly(L-alanylglycyl-L-alanylglycyl-L-serylglycine) (400.39) Ortho 9.39 9.05 20.55* 4 1.522 Poly(L-alanylglycyl-L-alanyl-L-prolyglycyl-L-proline) (450.49) Ortho 10.5 29.5 Poly(L-alanylglycylglycine) 11.(185.18) Mono 8.86 22.0 9.42 (3 = 90 9 1.507 (monohydrate) Mono C2-2 11.0 4.8 9.45 /9 = 90 2 1.35 Poly(L-alanylglycylglycylglycine) 11.(242.24) Hex 4.89 4.89 36.60 3 1.592 Poly(L-alanylglycyl-L-proline) dry Hex 11.9 11.9 28.8 10 1.06 wet Hex 11.4 11.4 9.3 3 1.07 (225.25) Poly(L-alanylglycyl-L-prolyl-L-prolyglycyl-L-proline) (476.53) Ortho 10.6 28.7 Poly(L-alanyl-L-prolyglycine) with H 2 O Mono C2-2 8.6 7.2 9.4 (3 = 90 2 1.4 (225.25) Poly(L-alanyl-L-prolylglycyl-L-prolyl-L-prolylglycine) (476.53) Hex 11.9 11.9 29.5 5 1.093 Poly(L-alanyl-D-valine) (170.21) Port 9.7 14.7 6.2 4 1.28 Ortho 9.5 29.4 11.1 16 1.459? Poly(2-aminoisobutyric acid) (85.11) Hex 8.7 8.7 5.96 3 1.08 - , dichloroacetic acid complex (106.60) Hex C3v-6 21.8 21.8 5.95 18 1.301 (1 DCA/6 residues) Poly(L-arginine) - , hydrochloride a helix Hex 14.7 14.7 27.0 18 1.406 (2.5 H2O/residue) (192.65) J3 Mono 9.26 22.05 6.76 7-108.9 4 1.438 (>5 H2O/residue)

Amorph.a

Melting point (°C)a

Heat of fusion kj/mola

Chain conform. (n*p/q) Refs.

8*1/1

969

10*1/1

969

7*2/1

969

15*2/1

1619

9*2/1

969

9*2/1

756

6*1/1 6*1/1 6*2/1

591 754 741

42*1/1

1648

36*1/1

1648

30*1/1

1648

24*1/1 24*1/1

1633 1648

18*

754

18*

755

9*1/1 9*1/1

596 740

12*3/1

740

9*10/3 9*3/1

614 614

18*

755

9*1/1

18*

616

755

6*1/1 6*2/1

1176 1046

3*3/1

967

3*3/1

1053

3*18/

641

3*2/1

641

References page VI-159

TABLE 5. cont'd Density (g/cm3)

Unit cell parameters Polymer

Cryst syst.

Poly(L-aspartic acid) -, P-benzyl© helix Tet (205.21) Tet Tet racemic Ortho -, - , /?-chloroa helix Hex (239.66) Hex ©helix Tet Mono - , - , /7-methyla helix Hex (219.24) ©helix Mono - , a-n-butyl1.(171.20) Hex Phex II. Tet - , a-ethyl- , - , 2-methoxy(173.17) Phex - , P-ethyl-, -, 2-phenyla helix Tet (219.24) P Ortho 71 helix Ortho >200°C Hex ? Hex -, a-isobutyl1.(171.20) Ortho Hex II. Tet Tet - , P-n-propyl P Mono (157.17) - , - , 3-phenyl(232.26) Hex (at 1400C) Ortho Poly(L-cysteine) - , s-benzyloxycarbonylP I. Ortho (237.27) II. Ortho - , 5-benzylthio© helix Tet (225.32) Poly(2,4-diaminobutyric acid) - , Af-benzyloxycarbonyl(234.26) Rho Poly(D-glutamic acid) -, y-benzyl- , -, chlorometa Phex (253.68) ortho Phex para Ortho Hex

Space group

5.30 5.42 5.3 5.68

4 4 4 2

1.341 1.320 1.34 1.310

3*4/1 3*4/1 3*4/1 3*2/1

582 703 837 1026

14.9 14.8 23.3 13.4

27.0 27 5.20 5.2

18 4 8 18

1.380 1.40 1.128 1.41

3*18/5 3*18/5 3*4/1 3*4/1

606 1505 606 1505

14.9

14.9

27

4

1.26

3*18/5

1505

16.6

13.4

5.28

7 = 108

4

1.304

3*4/1

1505

C2-2 C4-2

13.5 13.45 14.15

13.5 13.45 14.15

19.9 20.6 4.90

7=120

13 13 4

1.177 1.145 1.338

4*13/4 4*13/4 4*4/1

1507 1508 1508

C2-2

12.40

12.40

20.74

7 = 120

13

1.354

4*13/4

1508

13.2

13.2

27.0

18

1.393

3*18/5

1027

17.7 20.3 17.1 23.4

4.76 11.7 17.1 23.4

6.83 19.89 19.89

2 17 17

1.265 1.310 1.229

3*2/1 3*17/4 3*17/4

1027 1028 1028 1027

13.5 13.5 14.0 13.98

23.4 13.5 14.0 13.98

19.9 19.9 4.95 4.94

26 13 4 4

1.176 1.177 1.172 1.178

4*13/4 4*13/4 4*4/1 4*4/1

1312 1506 1312 1506

9.57

25.08

8

1.288

3*2/1

579

7 14

1.220 1.141

3*7/2 3*7/2

1628 1628

C2-2

13.85 13.80 13.88 21.4

13.85 13.80 13.88 4.28

14.9 14.8 23.3 16.4

15.6 28.0

C4-2

15.6 16.1

c

6.79b

Angles

7 = 99

7 = 96

10.5 10.5

Amorph."

Chain conform. (n*p/q) Refs.

Crystal.

D4-4

b

Heat of fusion kj/mola

z

D6-3

a

Melting point (0C)a

286/1310

4.76

32.4

6.95*

4

1.470

3*2/1

578

4.89

32.8

6.89*

4

1.426

3*2/1

578

14.28

14.28

5.55

4

1.322

3*4/1

1029

27.5

27.5

27.0

56

1.232

3*18/5

720

15.30

15.30

26.99

7 = 60.23

18

1.382

3*18/5

932

15.07 15.24 15.24

15.07 26.40 15.24

27.15 10.68 10.67

7 = 60.03

18 14 7

1.420 1.372 1.374

3*18/5 3*7/2 3*7/2

932 932 1033

TABLE 5. cont'd Density (g/cm3)

Unit cell parameters Polymer -, y-rt-hexyla helix (213.27) - , y-methyla helix (143.14) P

Cryst syst.

a

b

Hex

15.89

15.89

Hex

12.0

12.0

Ortho

Poly(L-glutamic acid) P I. Mono (129.12) Mono II. Mono Ortho -, y-w-amyl(199.25) Hex Hex -, y-benzyla helix A. Mono (219.24) Hex B. Tri Mono Mono (dry) Ortho Mono C. Hex (racemic) Hex Mono Hex D. Hex E. Hex single crystal Mono racemic mixture I. Ortho II. Mono -, -, chlorometa Hex (racemic) Hex (253.68) ortho Ortho (racemic) Hex para Ortho (racemic) Ortho - , y-w-butyl(185.22) Phex (at 1000C) Ortho -, y-calcium P (wet) Mono -, y-w-dodecyl(297.44) Hex -, y-ethyla helix I. Phex (157.17) Phex T. III. H. -, -, 2-chloro(191.61) -, -, 2-phenyl(233.27)

Space group

C2-2

c

Angles

27

9.49 9.44

19.09 23.37

7.07 6.81

9.66 9.79 9.75 4.95

9.10 9.35 8.06 15.6

6.98* 6.82* 6.84* 6.90

7 = 90

7=105 7=105 7 =104

Crystal.

18

1.08

Amorph."

Heat of fusion kj/mola

Chain conform. (n*p/q) Refs. 3*18/5

859

3*18/5

1162

8 8

1.484 1.266

3*2/1

954 812

4 4 4 4

1.447 1.422 1.644 1.610

3*2/1 3*2/1 3*2/1 3*2/1

585 966 966 836

18 18

1.12 1.13

3*18/5 3*18/5

1040 1279

3*18/5 3*18/5 3*18/5 3*18/5 3*18/5 *43/12 3*18/5 3*18/5 * 71/20 3*18/5 3*7/2 3*7/ 3*7/2

1030 952 587 702 952 757 1030 584 584 1030 1030 953 1030 926

15.1 15

15.1 15

15.3 30 15.25 25.2 15.88 14.76 29.06 14.95 14.95 15.05 14.8 39.05 64.36 5.52

14.6 30 15.25 15.0 13.00 25.40 13.20 14.95 14.95 14.78 14.8 39.05 64.36 5.11

24.4 25.6

15.4 15.6

15.50 15.49

15.50 15.49

27.10 26.84

18 18

1.345 1.360

3*18/5 3*18/5

1032 1035

26.50 15.24 15.24 15.12

30.60 15.24 26.40 26.09

27.02 27.23 10.67 10.72

72 18 14 14

1.384 1.384 1.374 1.394

3*18/5 3*18/5 3*7/2 3*7/2

1032 1034 1032 932

14.1 25.4

14.1 14.66

(27) 27

18 36

1.13 1.101

3*18/5 3*18/5

1040 1040

9.40

12.82

27.6

27.6

12.5 12.16

12.5 12.16

Tet Phex Ortho

11.72 12.9 22.95

11.72 12.9 13.25

Phex

11.7

11.7

Hex Ortho

15.60 15.38

15.60 26.65

(27) 27

z

Melting point (0C)*

7=121.7 27.0 26.8 27.1 64.11 27.27 27.1 106 27 10.50 10.58 10.5 22.25

84,84,122 7=122.5 7=113.7 (3 = 96 = 56

7

7 = 119.4

/3 = 97.8

72 18 30 18 86 36 18 71 18 7 49 2

1.257 1.278 1.279 1.303 1.260 1.305 1.260 1.252 1.279 1.277 1.285 1.171

1031 1031

7=107.7

6.83*

7 = 114

7=100.3

585 1292

27.0 108.9 16.4 108.9 108.9 108.9 16.56 (27) 54.4

7=110 7=109.5

18 73

1.18 1.255 1.274 1.25 1.151

3*18/5 *73/20 3*11/3 3*73/20 3*73/20 3*73/20

826 955 1036 955 955 955

7=123

73 73

7=118.7

11

1.760

3*11/3

1036

72

1.225 1.251

3*18/5 3*18/5

1038 1039

References page VI-159

TABLE 5. cont'd Density (g/cm3)

Unit cell parameters Polymer

Cryst syst.

Space group

a

b

c

Angles

z

Crystal.

Amorph.a

Melting point (°C)a

Heat of fusion kj/mola

Chain conform. (n*p/q) Refs.

- , y-n-hexyl-

(213.28)

Hex Hex

15.8 15.5

15.8 15.5

27 27

18 18

1.09 1.14

3*18/5 1040 3*18/5 1279

11.96 11.95 11.79

11.96 27.0 11.79

27.5

11.95 11.82 11.58

20.70 11.82 11.58

18 18 18 65 58 69 18

1.256 1.281 1.321 (1.284) 1.290 1.316 1.399

3*18/5 3*18/5 3*18/5 * 65/18 3*29/8 * 69/19 3*18/5

588 576 858 583 589 1204 1650

12.75 12.75 21.27 4.725 4.70

12.75 12.75 21.27

18 18

1.282 1.287 1.210

21

4

1.410

3*18/5 3*18/5 117/32 3*2/1 3*2/1

1293 1338 1204 702 1037

27.6 23.9

27.6 24.9

27

72 72

1.248

3*18/5 3*18/5

1041 1041

17.1

17.1

27

18

1.06

3*18/5

1279

14.4 24.6 24.3

14.4 14.2 24.3

(27) 60.0 60.0

18 80 120

1.19 1.085 1.112

3*18/5 * 40/11 *40/ll

1040 1040 1533

16.30

16.30

(27)

18

1.190

3*18/5

1038

15.9

15.9

-, y-methyla helix (143.14)

Hex Hex Hex

11.95

Ortho Hex Hex precursor to a (3 chloroform/18 mers) Hex Hex (at 17O0C) Rho P Ortho - , - , dimethyl phthalate complex 25% Hex extracted Phex - , y-n-octyl(241.33) Hex - , y-ft-propyl(171.20) Phex (at 1500C) Ortho Rho - , - , 3-phenyl(247.29) Hex - , y-sodium a helix Hex (hydrated) P (wet) Port Poly(L-glutamine) - , Af5-(4-hydroxybutyl)(200.24) Ortho - , //5-(2-hydroxyethyl)(172.18) Ptet - , N5-(3-hydroxypropyl)(186.21) Ortho Poly(D-glutamyl-L-glutamic acid) - , y-benzyla helix Hex (219.24) Hex Hex P Hex Ortho co helix Ortho Ortho Tc helix Hex Hex Ti-Ti 5.6 Hex Tt-Tt 7.2 Hex Tt-Tt 9.0 Mono Tt-Tt 10.8 Mono - , y-ethyl- , - , 2-phenyla helix Hex (233.27) Hex P Hex Tt helix Hex Poly(glycine) 1.(57.05) Mono C2h-5

14.4

7.0*

26.9 97.26 43.2 103.0 26.33 27.0 26.9 176.0 6.83 6.83

7 = 121.4

7 = 130

794 4.7

794

14.8

12.4

60.4

40

1.200

3*40/11

935

12.1

12.1

27

18

1.30

3*18/5

968

14.6

12.3

43.2

29

1.156

3*29/8

924

15.2 14.9 26.0 22.9 9.52 27 26.92 27.1 17.0 17.0 18.2 22.6 25.3 26.4

15.2 14.9 26.0 22.9 22.5 15.8 15.54 15.5 17.0 17.0 18.2 22.6 24.4 25.6

28 26.6 32.4 9.46

19 18 66 16

1.235 1.281 1.267 1.356

3*19/5 6*9/5 6*11/6 6*1/1

5.40 5.40 25.6 25.6 56.3 53.1 20.2 50.0

8 8 22 22 56 72 36

1.289 1.284 1.250 1.250 1.262 1.116 1.180 1.318

6*2/1 6*2/1 6*11/5 6*11/5 6*14/5 6*18/5 6*9/2 6*27/5

885 1042 1272 1042 1215 885 1042 1272 885 1272 1214 1214 1214 1214

15.9 27.5 24.2 17.6

15.9 27.5 24.2 17.6

26.5 32.4 4.75 25.7

18 66 8 22

1.204 1.205 1.286 1.236

6*9/5 6*11/6 6*1/1 6*11/5

1042 1272 1042 1272

2 4

1.30 1.669

3*2/1 3*2/1

581 1239

4.77 9.54

4.77 3.67

7.0 7.044*

7=117 7=118

7-66 7 = 113

365/795

TABLE 5.

cont'd Density (g/cm3)

Unit cell parameters Polymer

Cryst syst.

Space group

a

II. Hex C3-2 4.8 Poly(glycyl-6-aminocaproic acid) 1.(170.21) Hex 4.79 II. Mono 4.76 Poly(glycyl-12-aminododecanoic acid) 11.(254.37) Hex 4.79 Poly(glycyl-3-aminopropionic acid) 1.(128.13) Ortho 9.51 II. Hex 4.79 Poly(glycyl-3-aminopropionic acid-3-aminopropionic acid) (199.21) Hex 4.79 Poly(glycyl-11-aminoundecanoic acid) 1.(240.35) Ortho 9.60 II. Hex 4.79 Poly(glycylglycyl-L-proline) with H 2 O Mono C2-2 12.2 w/formicacid Mono C2-2 13.5 (211.22) Poly(glycylprolylhydroxyproline) (267.28) Hex 13.7 Poly(glycyl-L-prolyl-L-proline) dry Hex 12.5 (251.29) - , a-phenyl-(glycyl) (327.38) Ortho D2-4 14.3 Poly(L-histidine) -, 1-benzyl(227.27) Phex 17.4 - , hydrochloride (1 H2O/residue) Mono 14.95 (190.61) Poly(L-isoleucine) P Ortho 4.80 (113.16) Ortho 4.8 Poly(L-leucine) a helix Hex 13.22 (113.16) p Ortho 4.80 Poly(L-lysine) a helix Hex 19.55 (128.18) P Ortho 9.44 - , Zs-benzyloxycarbonyla helix Hex 16.69 (262.31) - , hydrobromide (1.4 H2O/residue) Ortho D2-3 9.52 (234.31) -, hydrochloride a helix Hex 16.80 >84%RH (164.64) P dry Ortho 4.62 65% RH Ortho 4.71 Poly(L-lysyl-L-lysyl-L-valine) a helix Hex 15.87 (355.48) P Ortho 9.35 (with 2HC1) - , di-benzyloxycarbonylP Ortho 9.38 (623.75)

b

c

4.8

9.3

4.79

35.1 3.96

4.79 15.20 4.79 4.79

Angles

16.95* 22.2 35.2

z

Crystal.

3

1.53

3

1.216

276/1524

10*3/1

1311 1311

6

1.131

230/1524

6*16/1

1512

16 3

1.389 1.447

7*2/1 7*3/1

1294 1294

3

1.419

11*3/4

1313

15*2/1 15*

1391 1391

37.5* 4.79 9.3 9.3

13.7

Heat of Chain fusion conform. kj/mol" (n*p/q) Refs. 3*3/1

/?=113

112.8

4.9 4.9

Amorph.a

Melting point (0C)"

2 2

1.4

9*1/1 9*1/1

615 615

28.2

10

0.97

9*10/

612

12.5

28.7

10

1.07

9*10/

613

13.5

9.4

4

1.198

9*1/1

965

17.4

27.0

7=130

18

1.085

3*18/5

719

14.95

45.0

7=116.5

45

1.582

3*15/4

1295

4 4

1.018 1.032

3*2/1 3*2/1

806 1025

22.36 23

6.88 6.6

/? = 90 /? = 94

273

13.22 23.56

6.88

4

0.966

19.55

3*

806

3*2/1

806

3*

586

17.16

6.8b

6

1.16

3*2/1

586

16.69

26.90

18

1.208

3*18/5

577

16.44

6.80

4

1.46

3*2/1

923

16.80

15.20 16.67

666

6.66 6.66

4 4

2.338

15.87

666 666 9*

1047

15.04

20.88

4

0.969

9*2/1

1047

28.24

20.22

8

1.547

9*2/1

1048

References page VI-159

TABLE 5. cont'd Density (g/cm3)

Unit cell parameters Polymer

Cryst syst.

Poly(L-methionine) a helix Hex (131.19) Poly(D-methionyl-L-methionine) P Mono (131.19) Poly(L-ornithine) -, iV-benzoyla helix Hex (218.26) -, -, /7-bromoco helix Ortho 8297.15* -, -, /7-chloroo) helix Ortho (252.70) -, -, />-fluoroco helix Ortho (236.25) - , iV-benzyloxycarbonyl1.(248.28) Mono Phex Hex II. Ortho Tet III. Ortho -, hydrobromide a helix Hex (>86% RH) P (wet) Ortho (to 85% RH) Poly(L-proline) 1.(97.12) Hex II. Rho Rho Rho -, acid complexes -,acetic Tet -,formic Tet • - , propionic Tet highly solvated Ortho - , hydroxyA. (113.12) Hex B. >66%RH Phex - , - , O-acetyl11.(155.15) Hex Poly(L-serine) -, O-acetylP Ortho (129.12) Poly(L-tyrosine) -, (9-benzyloxycarbonyl(297.31) Mono Poly(L-valine) a helix Hex (99.13) P Ortho Ortho a b

Space group

a

b

c

11.49

11.49

70.5

18.05

4.71

15.0

D2-4

14.66*

15.0

26.5

24.6

18.4

Angles

/3=110.4

5.68

z

Crystal.

Amorph.*

Melting point (°C)a

Heat of fusion kj/mola

Chain conform. (n*p/q) Refs.

47

1.270

3*47/13

867

8

1.492

6*2/1

850

18

1.263

3*18/5

1373

8

1.535

3*4/1

1373

D2-4

24.1

18.5

5.68

8

1.326

3*4/1

1373

D2-4

23.8

18.7

5.68

8

1.241

3*4/1

1373

23.3 23.0 22.8 29.40 20.8 22.09

22.7 22.6 22.8 14.70 20.8 19.95

22 22 22 36 80 80

1.213 1.238 1.228 1.272 1.270 1.247

3*11/3 3*11/3 3*11/3 3*18/5 3*40/1 3*40/1

720 1043 1296 1043 1296 1296

16.2 (16) 16.4 27.0 60.00 60.00

7=119.2 7 = 119.5

15.0 4.60

C2-2 C3-3 C3-3 C3-3

C3-3

30.2

6.64

8

9.05 6.62 6.62 6.68

9.05 6.62 6.62 6.68

19.0 9.36 9.31 9.36

10 3 3 3

9.13 8.92 9.13 9.00

9.13 8.92 9.13 25.1

19.0 19.0 19.0 19.0

10 10 10

12.3 15.75

12.3 15.75

9.15 22.88

11.4

11.4

9.71

D2-4

784

6.48

18.0

18.0

11.43

11.43

4.79 4.80

19.00 19.14

1.197 1.362 1.369 1.338

3*2/1

784

3*10/3 3*3/1 3*3/1 3*3/1

590 510 512 511

3*10/3 3*10/3 3*10/3

701 701 701 701

9

1.410

3* 3*8/3

580 1044

9.3

6

1.48

3*3/1

737

9.6*

3

1.065

3*3/1

706

11

1.20

3*11/3

849

18

0.970

3*18/5

1025

4 4

1.052 1.088

3*2/1 3*2/1

806 1045

16.5 (27) 6.88 6.59

7 =120.47

7=122

The number after the solidus (/) are reference citations. The unit cell parameter assignment has been changed from that published so as to make c the fiber axis.

TABLE 6. POLY(AMIDES) (-NH-X-NH-CO-Y-CO- or -NH-X-CO-) see also POLY(PEPTIDES) Density (g/cm3)

Unit cell parameters Polymer

Cryst syst.

Space group

Poly(2-aminoacetic acid), see Polyglycine Poly(/?-aminobenzoic acid) (119.12) Ortho D2-4 Ortho D2-4 Ortho D2-4 Poly(3-amino-2-butenoic acid) irrad. in vacuum (83.09) Mono irrad. in air Mono Poly(3-aminobutyric acid) (85.11) Ortho Poly(4-aminobutyric acid) a Mono (85.11) Mono C2-2 Mono P Mono 5 Hex -, 4-benzyloxycarbonyl-(L) 1.(219.24) Mono II. Hex - , 4-methyloxycarbonyl-(L) (143.14) Hex PoIy(10-aminocapric acid) a Tri (169.27) y Phex C2h-5 Hex Poly(6-aminocaproic acid) [caprolactam] a Mono C2-2 (113.16) Mono C2-2 Mono Mono C2-2 Mono Mono Mono C2-2

P Y

>150°C

Hex Hex Mono Mono Hex Ortho Mono Ortho Rho Mono

C2h-5 C2h-5

a

b

c

7.71 7.71 7.75

5.14 5.14 5.30

12.9 12.8 12.87

19.11

8.54

10.665

21.90

10.13

12.461

10.9

9.6

4.6

9.44 9.29 9.79

8.22 7.97 8.31

4.65

4.65

9.62 13.14

Angles

z

Crystal.

4 4 4

1.548 1.560 1.497

Amorph."

Melting point (°C)a

Heat of fusion kj/mol*

550/735

Chain conform. (n*p/q) Refs.

6*2/1 6*2/1 6*2/1

811 902 1434

/3 = 91.6

4*

1530

/3 = 96.8

4*

1530

4

1.17

330

4*1/1

503

260/337 260/244

5*2/1 5*2/1 5*2/1 5*2/1

272 457 1509 458 458

12.1* 12.24* 12.25 12.24*

7=116 7=114.5 7=117

8 8 8

1.340 1.375 1.273

19.30 13.14

12.30 10.0

(3 = 11.1

8 5

1.35 1.22

5*2/1 5*5/2

1359 1359

10.90

10.90

10.0

5

1.16

5*5/2

1359

9.80

5.12

27.54

54,90,110

4

1.110

11*2/1

1237

4.78 4.9

9.56 4.9

26.9 26.5

7=120

4 2

1.056 1.02

11*2/1 11*2/1

971 61

9.56 4.81 9.65 9.45 9.66 4.77 9.71

8.01 7.61 8.11 8.02 8.32 4.06 8.19

17.24* 17.10* 17.2* 17.08 17.0 17.25 17.40

7 = 67.5 7 = 79.5 7 = 66.3 7 = 68 7 = 65 7 = 66.5 7=115

8 4 8 8 8 2 8

1.232 1.221 1.220 1.252 1.214 1.224 1.199

1 1 4 4 2 4 4 4 4 2

1.250 1.23 1.10 1.10 1.162 1.165 1.132 1.194 1.188 1.191 1.146 1.138

4.8 4.85 9.35 9.33 4.79 4.82 9.14 4.83 4.90 4.86

4.8 4.85 4.81 4.78 4.79 7.82 4.84 7.83 16.28 4.65

8.6 8.4 16.60* 16.88* 16.7 16.70 16.68 16.68 8.22 16.87

17.9

16.2*

7 = 59.7

16.96*

7 = 90

7=120 7=121

7=121

7 = 60

188/337 177/146 1.09/839

0.917 1.114 1.10

1.09/839

215 223/153 223/244 226/293 214/304 272/839 260/1051 228/346 250/532

272/839

20.8/155 18.1/216 23.0/405 21.6/343 26/1121 19.4/839 27/1050 27.3 24.1/697 18.5/534

7*2/1 7*2/1 7*2/1 7*2/1 7*2/1 7*2/1 7*2/1

7*1/1 7*1/1 15.6/839 7*2/1 27/1050 7*2/1 7*2/1 7*2/1 7*2/1 7*2/1 7*1/1 7*2/1

3 26 135 212 334 891 1049 1050 449 213 222 1052 336 246 272 279 697 697 26 891

-, complex with 12

-, D-(-)-3-methyl(127.19)

Mono or

C2h-5 C2-2

9.13

Mono

C2-2

9.15

4.84

Poly(6-aminocaproic acid-a/f-11-aminoundecanoic acid) (296.46) Poly(6-aminocaproyl-5-aminovaleryl-3-aminopropionic acid) (297.40) Tri 4.9 10.7 Poly(8-aminocaprylic acid) a Mono C2-2 9.8 8.3 (141.21)

1510

4

1.125

22.5 21.6

51,77,62

2

1.28

22.4*

7=115

8

1.14 1.18

225/19 226/36

7*2/1

440

184

19*1/1

714

18*1/1

1437

185/146 202

30/1195 9*2/1

272 153

200/244 218/838

References page VI-159

TABLE 6.

cont'd Density (g/cm3)

Unit cell parameters Polymer

Cryst syst.

Space group

P y

Mono Hex Hex Phex C2h-5 Poly(2-aminocyclopentylenecarboxy acid) (111.14) Poly(7-aminoenanthic acid) (127.19) Tri Cl-I Tri Ci-I

a

b

c

4.79 4.9 4.77

4.79 4.9 9.54

21.7 21.7 21.9

8.25

4.54

7.8

9.8 4.9

10.0 5.4

9.8 9.85

Angles

z

Crystal.

Amorph."

1.088 1.04 1.087

1.04/495

7 = 120

2 2 4 2

1.26

4 1

1.18 1.21

56,90,69 49,77,63

Melting point (°C)a

13.3 Poly(peptide) Section

C2h-5

Ci-I Cl-I

Poly(2-aminopropionic acid), see Poly(alanine) Poly(3-aminopropionic acid) [P alanine] a Mono C2-2 (71.08) Mono P Ortho - , 2-butyl-2-methyl(141.21) - , 2,2-dimethyl1.(99.13) II. Ortho

13.3

Chain conform. (n*p/q) Refs.

18/1121 9*2/1 9*2/1 9*2/1

121 272 61 971

4*2/1

1059

8*1/1 8*1/1

918 61 153

233/215 225/146 217

1.20 -, (R)-3-methyl(141.21) - , (S)-4-methyl(141.21) -, (R)-5-methyl(141.21) - , (R)-6-methyl(141.21) Poly(aminoformic acid) - , N-butyl(99.13) Phex Poly(2-aminoisobutyric acid), see PoIy(12-aminolauric acid) Y Hex (197.32) Hex Phex Mono Mono Mono formed during planar extrusion Tri Poly(9-aminopelargonic acid) (155.24) Tri Tri

Heat of fusion kj/mola

223/291

9.24

179

479

9.43

176

479

9.11

182

479

9.57

188

479

15.4

16

1.12

1.023 1.10 1.034 1.045 1.048 1.126

2*8/3

522

208/1172 179/177

13*2/1 13*2/1 13*2/1 13*2/1 13*2/1 13*2/1

895 660 680 759 1054 1511

13*2/1

1511

4.80 4.70 4.79 4.87 4.90 9.28

4.80 4.70 9.58 9.38 4.67 4.85

32.1 31 31.9* 32.2* 32.1 31.35

7 = 120 7 = 121.5 7=121.7 7=124.4

2 2 4 4 2 4

9.28

5.29

31.35

59,90,60

4

1.223

4.9 9.7

5.4 9.7

12.5 12.6

49,77,64 64,90,67

1 4

1.15 1.07

210 194/146 198/292 209/177

10*1/1 10*1/1

421 918

9.33 9.60

8.73 8.96

4.78* 4.78*

7=120 7=122.5

4 4

1.400 1.361

340 330/337 357/1403

4*1/1 4*1/1

491 1265

9.56

7.56

4.78 a

4

1.366

4*1/1

1265

4*2/1

1093

11.57

-, 2-ethyl-2-methyl(113.16) -, 3-methyl-, see Poly(3-aminobutyric acid) -, 2-methyl-2-propyl(127.19) Poly(3-aminopropyl-5-aminovaleryl-6-aminocaproic acid) (297.40) Tri 4.9 PoIy(18-aminostearic acid) y Mono 4.76 (281.48) Poly(2-aminotetrahydropyran-6-carboxcylic acid) (127.14) Mono C2-1 11.79

10.95

10.7

0.972

175/528

0.99

8.3

72

8.4 8.39

189/73 273 268 270/402

8

1.239

4* 13 4*2/1

73 1093

8.5

76

4*2/1

1093

8.4

74

4*2/1

1093

21.6

51,77,62

2

1.28

18*1/1

1437

9.52

46.9

7 = 120

4

1.016

19*2/1

1055

14.40

19.43

7 = 98

20

1.292

5*10/3

1333

Double

305

TABLE 6. cont'd Density (g/cm3)

Unit cell parameters Polymer

Cryst syst.

PoIy(11-aminoundecanoic acid) a Tri (183.30) Tri Tri Tri Tri

II. y

Space group

Cl-I Ci-I

Mono Mono

a

b

c

9.5 4.78 4.9 9.6 4.78 4.78

10.0 4.13 5.4 4.2 4.13

9.75 9.48

Poly(5-aminovaleric acid) a Tri Cl-I 9.5 (99.13) Poly(4,4 '-benzanilidylene terephthalamide) (357.37) Poly(1,3-cyclohexylenedimethylene adipamide) cis(252.36) Tri 4.8 Poly( 1,3-cyclohexylenedimethylene dodecanediamide) cis(336.52) Tri 4.8 Poly(1,3-cyclohexylenedimethylene suberamide) cis(280.41) Tri 4.8 Poly(decamethylene adipamide) [10.6] (282.43)

Angles

z

Crystal.

15.0 13.1 14.9 15.0 14.9 14.1

60,90,67 90,75,66 49,77,63 72,90,64 82,75,66 a = 63.5

4 1 1 2 1

1.10 1.343 1.15 1.19 1.174

8.02 4.5 7.68

15.0& 29.4^ 14.78

7=115 7 = 118.5

4 4

1.145 1.10

5.6

7.5

48,90,67

2

1.30

Chain conform. (n*p/q) Refs.

183/292 220 182/146 194/101 186 188/444 226/1161

27/1161 41/343

12*1/1 12*1/1 12*1/1 12*1/1 12*1/1 12*1/1

918 365 61 59 263 1057

12*1/1 12*1/1

529 529 1056

258/402

6*1/1

18*1/1

1425

13*2/1

1058

29.6

26,85,75

2

1.19

19.0

44.6

16,90,83

2

1.12

19*2/1

1058

14.5

34.8

22,85,76

2

1.15

15*2/1

1058

18*1/1

110

20.0

253/1201

918

12.6

230 236/244 240/544 214/137

y Phex Poly(4,4 '-decamethy lenedipiperazine sebacamide) (476.75)

Poly (decamethy lene succinamide) [10.4] (254.37) Tri 4.9 Poly(dodecamethylene oxamide) [12.2] (254.37) Poly(dodecamethylene phosphinylidenedipropionamide) - , methyl-(diacid) (372.49) Poly(dodecamethylene malonamide) [12.3] (268.40) Mono 8.48 Poly(dodecamethylene sebacamide) [12.10] a Tri 5.0 (366.59) P Tri 5.0 Poly(dodecamethylene succinamide) [12.4] (282.43) Tri 4.9

1.01

Heat of fusion kj/mol a

18.63

Poly(decamethylene azelamide) [10.9] (324.51)

Poly(decamethylene 4-octenediamide) trans(308.47) Poly(decamethylene phosphinylidenedipropionamide) - , methyl-(diacid) (344.44) Poly(decamethylene sebacamide) [10.10] (338.54) Tri 4.9

Amorph.a

Melting point (°C)a

68.2/405 2 1 * 36.7/159

2

65 130/159 129/402

69.1/159 28*

24.1

243

20*1/1

657

20

173

19*1/1

831

51.1/118 22*1/1 34.7/159 * 1/1 72.0/405 32.7/160

1412 110

5.4

27.8 25.6

49,76,63

1

1.14

203/244 197 198/454 216/137

5.5

19.8

49,77,63

1

1.18

242

16*1/1

1626

19.5

230

16*1/1

743

21.55

180

4.71

41.30

/5=101

4

1.101

5.25

29.2

51,75,63

1

1.15

8.16

29.2

90,75,68

1

1.15

5.5

22.3

49,77,63

1

1.17

173/339

237

831 17*2/1

1523

24*1/1

1513

24*1/1

1513

18*1/1

1626

References page VI-159

TABLE 6.

cont'd Density (g/cm3)

Unit cell parameters Polymer

Cryst syst.

Space group

a

b

Poly[4,4 '-(ethylenedioxydiphenylene)-ditrimethylene adipamide] (438.57) Poly(ethylene-L-tartaramide) - , di-O-methyl(202.21) Tri 4.95 6.87 Poly(heptamethylene adipamide) [7.6] Y Phex C2-2 (240.35) Poly(heptamethylene y (282.43) Poly(heptamethylene (254.37)

c

Angles

4.82

Crystal.

Amorph."

Heat of fusion kj/mola

26.3

9.10

59,90,106

azelamide) [7.9] Phex pimelamide) [7.7] Phex Cs-I

z

Melting point (°C)a

18.95*

7=120

1

1.337

312

Chain conform. (n*p/q) Refs.

25*1/1

516

8*1/1

1629

2

209/291 226/339 250/244

65

1

201/244

65

1

1.105

214/244

16*1/1

63

16*1/1

65

205/2 196/339 228/1625

Y Phex Poly(heptamethylene sebacamide) [7.10] Y Phex C2-2 (296.46) Poly(heptamethylene suberamide) [7.8] Y Phex C2-2 (268.40) Poly(hexamethylene adipamide) [6.6] a I. Tri Ci-I (226.32) Mono Tri Tri Tri Tri

II.

Tri

P

4.9 15.7 5.00 4.87 4.97 4.96

glutaramide) [6.5] Mono C2h-6 Mono malonamide) [6.3] Mono 4-octenediamide)

5.4 10.5 4.17 5.26 5.47 5.52

187/339 208/244

65

2

230/244

65

8.0 5.9 5.87

17.2 16.23 16.50

90,77,67 57,80,60 56,81,60

2 1 1

7.8

5.3

40.15*

7 = 87

4

1.08

4.60 5.23

8.62 8.50

30.95* 30.55

/3=114 /3=110

4 4

8.60

4.62

25.70

/3=100.4

4

17.12

48,77,63 0 = 73 81,76,63 50,76,64 48,77,62 48,76,62

2

4.9 5 4.91

5.45

17.2 17.3 17.3 17.15 17.29 17.41

1

1.24 1.240 1.204 1.241 1.214 1.208 1.225 1.220 1.152 1.165 1.25 1.10 1.119

4.95

P Tri Ci-I high temp. Tri (17O0C) Tri Poly(hexamethylene azelamide) [6.9] (268.40) Mono Poly(hexamethylene (212.29) (at 19O0C) Poly(hexamethylene (184.24) Poly(hexamethylene trans(252.36) Poly[hexamethylene (170.21) Poly(hexamethylene (318.41) Poly(hexamethylene a (282.43)

18.95

52,80,63

1 9 1 1 1 1

1

1.09/52 1.12/495

14*1/1 14*1/1 14*1/1

25 402 407 891 1180 1409 1179 54 1180 1179 25 1060 1409

Tri

Ci-I

46.5/82 40/155 36.8/216 68/1121 58/1166 46.9/405 53.2

14*1/1 14*1/1 14*1/1 14*1/1 14*1/1 14*1/1

269.5

43.4 41.9

14*1/1

226/244 185/339

17*2/1

402

1.258 1.105

241/402

13*2/1 13*2/1

1514 1514

1.218

241/1524

11*2/1

1523

259

16*1/1

657

1.095 1.069 1.095 1.09/495

19.1 oxamide) [6.2] Tri Ci-I /n-phenylenedisulfonamide) Mono C2h-3 sebacamide) [6.10] Tri Ci-I Tri

265/2 270/289 301/1166 280/1121

5.15

7.54

12.39

32,74,62

1

1.280

320/402

10*1/1

956

7.70

7.76

14.1

/3=117

2

1.409

170

13*1/1

1384

4.95 4.86

5.4 5.05

22.4 22.35

49,76,63 55,76,62

1 1

1.16 1.189 1.152 1.189 1.17 1.20

228/51 215/291 233/244 225/454 216

30.6/160 18*1/1 56.5/137 18*1/1 58.6/405

25 891 54 52 153 25

4.9

8.0

22.4

90,77,67

2

1.041

18*1/1

TABLE 6. cont'd Density (g/cm3)

Unit cell parameters Polymer

Cryst syst.

Space group

Poly(hexamethylene suberamide) [6.8] (254.37) Tri Mono quenched Phex Poly(hexamethylene succinamide) [6.4] (198.26) Tri

a

b

9.60

8.26

9.7

9.7

4.9

5.3

c

Angles

z

Crystal.

19.7

7 = 115

1 4

1.193

Amorph.a

Melting point (°C)a

Heat of fusion kj/mola

232/244 235/291 241/1202

Chain conform. (n*p/q) Refs.

16*1/1

7=120 14.8

51,77,62

65 1515 1515

1

1.25

275

12*1/1

1626

230

12*1/1

1629

371 371/829 D350/291

14*1/1

828

285/1524 306/402

9*2/1

1522

212/402 Poly(hexamethylene-L-tartaramide) - , di-O-methyl(252.32) Tri Poly(hexamethylene terephthalamide) [6.T] (246.31)

Poly(methylene adipamide) [1.6] (156.18) Mono

C2h-6

5.00

13.20

62,90,112

1

1.191

15.6

8.04

4

1.333

39.5

4

1.06

20*2/1

1315

6.06 6.1 5.22

45.0 45.5 52.6

4 4 4

1.060 1.03 1.037

23*2/1 23*2/1 23*2/1

1315 1315 1315

6.1

35.8

4

1.08

18*2/1

1315

5.32

40.5

4

1.093

18*2/1

1315

6.1

41.4

4

1.05

21*2/1

1315

6.1

37.6

4

1.07

19*2/1

1315

6.1

49.4

4

1.02

25*2/1

1315

6.1

47.4

4

1.02

24*2/1

1315

6.1

43.5

4

1.04

22*2/1

1315

4.96

44.7

4

1.059

23*2/1

1440

10.52 9.64

4.96 4.96

44.7 44.7

4 4

1.118 1.220

23*2/1 23*2/1

1440 1440

8.12

4.79

35.2*

3

1.166

15*2/1

1522

4.79

4.79

26.1

3

1.366

8*3/1

1522

4.79

4.79

18.0

3

1.589

6*3/2

1313

4.79

4.79

34.5

3

1.237

10*3/1

1522

8.10

4.79

30.0*

4

1.211

13*2/1

1522

Poly (4,4'-methylenedicyclohexylene azelamide) trans-, trans (362.56) Ortho 9.4 Poly(4,4 '-methylenedicyclohexylene dodecanediamide) trans-, transI. Ortho C2v-5 9.30 (404.64) Ortho 9.4 II. Mono 9.50 Poly(4,4 '-methylenedicyclohexylene pimelamide) trans-, transit Ortho 9.4 (334.50) II. Mono 9.57 Poly(4,4 '-methylenedicyclohexylene sebacamide) trans-, trans(376.58) Ortho 9.4 Poly(4,4 '-methylenedicyclohexylene suberamide) trans-, trans(348.53) Ortho 9.4 Poly(4,4'-methylenedicyclohexylene tetradecanediamide) trans-, trans(432.60) Ortho 9.4 Poly(4,4 '-methylenedicyclohexylene tridecanediamide) trans-, trans(418.66) Ortho 9.4 Poly(4,4 '-methylenedicyclohexylene undecandediamide) trans-, trans(390.61) Ortho 9.4 Poly(4,4 '-methylenediphenylene dodecanediamide) 1.(392.54) Ortho 11.10 II. Ortho III. Ortho Poly(methylene dodecanediamide) [1.12] (240.35) Mono C2h-6 Poly(methylene glutaramide) [1.5] (142.16) Rho D3-5 Poly(methylene malonamide) [1.3] (114.10) Hex Poly(methylene pimelamide) [1.7] (170.21) Rho D3-5 Poly(methylene sebacamide) [1.10] (212.29) Mono C2h-6

6.84

4.79

20.2*

6.1

7 = 90

7 = 96.6

7 = 99.6

7

= 90

7 = 90

290 256/1443

259/1524

260/4024

266/1524 268/1537

References page VI-159

TABLE 6. cont'd Density (g/cm3)

Unit cell parameters Polymer

Cryst syst.

Space group

Poly(methylene suberamide) [1.8] (184.24) Mono C2h-6 Poly(nonamethylene azelamide) [9.9] (310.48)

y Phex Poly(nonamethylene malonamide) [9.3] (226.32) Ortho Poly(octamethylene azelamide) [8.9] Y Phex (296.46) Poly(octamethylene malonamide) [8.3] (212.29) Mono Poly(octamethylene suberamide) [8.8] (282.43) Tri Poly(octamethylene succinamide) [8.4] (226.32) Tri Poly(octamethylene-L-tartaramide) - , di-O-methyl(286.37) Tri Poly(octamethylene terephthalamide) [8.T] (274.36) Poly(pentamethylene azelamide) [5.9] (254.37) Poly(pentamethylene glutaramide) [5.5] (198.26) Mono C2-3 Poly(pentamethylene malonamide) [5.3] (170.21) Ortho Poly(pentamethylene pimelamide) [5.7] y Mono Cs-2 (226.32) Poly(pentamethylene terephthalamide) [5.T] (232.28) - , 2-methyl-(diamine) (246.31) Ortho Poly(3,8-phenanthridinonediyl terephthalamide) (355.35) Mono Poly(m-phenylene adipamide) (218.26) Poly(p-phenylene dodecanediamide) (302.42) Poly(m-phenylene isophthalamide) (238.25) Ortho Tri Cl-I Tri Cl-I Ortho - , hexamethylphosphorictriamide complex (596.66) Mono (2 HMPT/monomer) Poly(/?-phenylene phthalamide) (238.25) Ortho D2h-14 Poly(p-phenylene pimelamide) (232.28) Poly(m-phenylene sebacamide) (274.36) Poly(/7-phenylene sebacamide) (274.36)

a

8.08

b

4.79

c

25.2^

Angles

z

Crystal.

= 90

4

1.255

7

24.0

Amorph.a

Melting point (°C)a

Heat of fusion kj/mola

Chain conform. (n*p/q) Refs.

276/1524

11*2/1

1522

177 189/2 165/339

20*1/1

110

1 8.32

4.71

32.70

4

65 1.173

2

8.50

4.71

30.70

/5=101.7

4

14*2/1 206/244

1.172

1

233/1524

1523 65

13*2/1

216/291 225/244

1523 65

4.9

5.4

17.3

51,77,62

1

1.20

254

14*1/1

1626

5.00

6.82

15.7

57,90,111

1

1.175

208

14*1/1

1629

17.9

335

16*1/1

828

19.5

179/291

16*1/1

2

8.30

4.79

13.8

8.47

4.62

22.40

4.83

9.35

16.62

7

7

= 90

= 58.9

2

1.200

198/291 247/1625

12*1/1

1624

4

1.290

195/402 248/1524

10*2/1

1523

2

1.169

228 183/291

14*1/1

1210

354 353/829

13*1/1

828

1.460

13*2/1

1529

1.50

16*1/1

1063

11*1/1

828

19*1/1

828

10*1/1 10*1/1 10*1/1 10*2/1

735 856 878 1062

14.1

4.61

36.7

26.5

8.1

6.5

17.2

16 7

= 60

2

11.8

344 296/402

21.2 6.7 5.27 5.36 5.1

4.71 5.25 5.36 5

11.0 11.3 11.3 23.2

112,111,88 113,113,88

1 1 1 2

1.14 1.470 1.443 1.34

9.43

16.94

11.3

/3-123.4

2

1.315

5.5

8.1

4

1.56

22.8

375/735 390/748 1.33

957

10*1/1

396

14.7

372

14*1/1

828

14.9

258

17*1/1

828

18.5

334

18*1/1

828

TABLE 6. cont'd Density (g/cm3)

Unit cell parameters Polymer

Cryst syst.

Space group

Poly(m-phenylene suberamide) (246.31) Poly(p-phenylene suberamide) (246.31) Poly(m-phenylene terephthalamide) (238.25) - , 4-methyl-(diamine) (252.27) Mono Poly(/?-phenylene terephthalamide) 1.(238.25) Port Cs-I Mono Mono C2h-5 Ortho Mono Port Cs-2 Ortho II.

a

b

c

Angles

z

Crystal.

Amorph.a

Melting point (°C)a

Heat of fusion kj/mola

Chain conform. (n*p/q) Refs.

13.0

302

15*1/1

828

16.3

374

16*1/1

828

11*2/1

1398

12*1/1 12*1/1 12*1/1 12*1/1 12*1/1 12*1/1 12*1/1

761 1061 902 1525 1527 1620 1638 1526 958 1526

500/748 8.57

7.54

22.11

/3=116.3

4

1.308

7.87 7.728 7.80 7.78 7.79 7.88 7.60

5.18 5.184 5.19 5.28 5.18 5.22 5.04 4.8 5.1 4.8

12.9 12.81 12.9 12.9 12.89 12.9 12.78 12.7 12.9 12.7

7 = 90 7 = 90.04 7 = 90

2 2 2 2 2 2 2

1.504 1.542 1.515 1.493 1.522 1.491 1.616

2

1.50

8.0

7 = 92.2

500/748 600/735

a = 88 12*1/1

a = 88

single crystals & spherulites 11.5 - , 2,2'-difluoro(274.23) Port 8.6 5.0 Poly(/?-phenylene 2,5-thiophenediamide) (272.46) Mono 4.29 5.09 Poly(piperazine adipamide) (196.25) Poly( 1,4-piperazine 1,3-cyclobutylenedicarboximide) - , 2,4-diphenyl-(diacid) trans(346.43) Ortho 8.74 5.93 Poly( 1,4-piperazine 4-octenediamide) trans(222.29) Mono C2h-5 4.54 10.00 Poly(piperazine sebacamide) (252.36) Poly(2,5-pyrimidine terephthalamide) (240.22) Ortho 7.3 5.1 Poly(4,4 '-sulfonyldiphenylene terephthalamide) (378.40) Poly(terephthaloyldihydrazo-di(p-aminobenzoyl) terephthalamide) (562.54) Port 8.5 4.9 Poly(tetramethylene adipamide) [4.6] (198.26) Tri Cl-I 4.95 5.47 Mono 9.6 8.26 Tri 4.9 5.5 Poly(tetramethylene Y (240.35) Poly(tetramethylene 156.18* Poly(tetramethylene trans(224.30) Poly(tetramethylene (170.21)

1297

13.0 25.2

7 = 98

1.63

12*1/1

1528

2

1.489

11*2/1

1532

10*1/1

386

9*1/1

934

12*1/1

873

9.2

355

9.22

13.50

/?=110.2

1

1.204

2

1.283

12.8

2

4.62

Poly(tetramethylene-L-tartaramide) - , di-O-methyl(230.26) Tri

16* 12*1/1

15.45 29.69 14.66 14.7 14.8

20.40

1531 1203

48,78,64 7=115 46,78,64

2

1.51

1 4 1

1.245 1.246 1.29

/?= 102.5

4

295/291 308/51 350 41.6 319/1518

28*1/1

760

12*1/1 12*1/1 12*1/1

1516 1517 1655

223/339 253/402 1.303

17.0 succinamide) [4.4] Tri

26.0/81

1.67

2

8.65

252/657 180/81

azelamide) [4.9] Phex malonamide) [4.3] Mono 4-octenediamide)

2

65

277/1524

9*2/1

1523

294

14*1/1

657

4.9

5.5

12.3

49,77,62

1

1.29

d 287/402

10*1/1

1626

5.00

7.06

10.80

59,90,110

1

1.270

266

10*1/1

1629

References page VI-159

Next Page

TABLE 6. cont'd Density (g/cm3)

Unit cell parameters Polymer

Cryst syst.

Space group

Poly(tridecamethylene tridecanediamide) [13.13] y Mono (422.70) Mono Poly(m-xylylene adipamide) (246.31) Mono Tri Ci-I Poly(/7-xylylene sebacamide) (302.42) Tri

a b

a

b

c

9.22 4.88

4.94 4.73

34.47 34.0

5.10 12.01

4.70 4.83

15.2 29.8

5.74

4.87

20.6

Angles

z

Crystal.

Amorph."

/3=121.1 7=121

2 1

1.044 1.043

1.01

' = 69.6 75,26,65

1 2

76,55,65

1

7

Melting point ( 0 C) a

Heat of fusion kj/mola

Chain conform. (n*p/q) Refs.

> 183 97.2 172/1521

28*1/1 28*1/1

1519 1520

1.198 1.250

246/326 244/544

13*1/1 13*2/1

84 459

1.168

300/290 281/385 291/454 268/291

18*1/1

204

The number after the solidus (/) are reference citations. The unit cell parameter assignment has been changed from that published so as to make c the fiber axis.

TABLE 7.

POLY(ESTERS) ( - O - X - O - C O - Y - C O - or - O - X - C O - ) Density (g/cm3)

Unit cell parameters Polymer

Cryst syst.

Space group

a

Poly(4,4 '-bicyclohexylene sebacate) - , trans-, trans(364.53) Mono 11.16 smectic Mono 11.98 Poly(4,4'-bicyclohexylene undecanedioate) - , trans-, trans(378.55) Mono 12.4 smectic Mono 12.3 Poly(4,4 '-biphenylene 4,4'-biphenylenedicarboxylate) (392.11) Ortho 7.83 Poly(4,4 '-biphenylene terephthalate) (316.31) Ortho 7.20 Poly(3,4 '-carbonyldiphenylene terephthalate) (344.32) Ortho C2v-17 12.51 Poly(l,3-cyclobutylene carbonate) - , 2,2,4,4-tetramethyltrans(170.21) Tri 9.25 cisOrtho 9.16 Poly(l,4-cyclohexylene adipate) trans(226.27) PoIy(1,4-cyclohexylenedimethylene adipate) transI. Mono C2h-5 6.938 (254.33) cis-

b

Amorph.a

Melting point ( 0 C) 0

Heat of fusion kj/mola

Chain conform. (n*p/q) Refs.

c

Angles

z

Crystal.

5.27 5.48

19.48 19.76

/3 = 49.0 /3 = 52.5

2 2

1.400 1.176

20*1/1 20*1/1

1636 1636

5.21 5.55

23.0 20.6

/3 = 43.5 /3 = 51.4

2 2

1.229 1.144

21*1/1 21*1/1

1636 1636

5.50

20.66

2

1.464

20*1/1

1622

16*

1622

16*4/1

1562

5.23 7.561

67.66

8.28

(6.9)

8.22

12.9

16

7

= 96.5 4

1.4292

1.08

360

6*1/1

364

1.164

253

6*2/1

364

225/762

12*1/1

763

124/547

14*1/1

1262

12*1/1

1193

13.5

9.761

15.97

/3 = 41.4

2

1.181

55/547 PoIy(1,4-cyclohexylenedimethylene succinate) trans(226.27) Mono C2h-5 cis-

6.486

9.482

13.51

/3 = 45.9

2

1.259

147/547 62/547

Poly(1,4-cyclohexylenedimethylene terephthalate) trans(274.32) Tri Tri Ci-I cisTri

6.37 6.46

6.63 6.65

14.2 14.2

89,47,114 89,47,115

1 1

1.266 1.260

318/547

14*1/1 14*1/1

199 1077

6.02

6.01

13.7

89,53,112

1

1.319

256/547

14*1/1

199