MOLECULAR MECHANICS - THE MM3 FORCE-FIELD FOR HYDROCARBONS .3. THE VANDERWAALS POTENTIALS AND CRYSTAL DATA FOR ALIPHATIC AND AROMATIC-HYDROCARBONS

被引：817

作者：

LII, JH ^{[1
]}

ALLINGER, NL ^{[1
]}

机构：

[1] UNIV GEORGIA,SCH CHEM SCI,DEPT CHEM,ATHENS,GA 30602

来源：

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY | 1989年 / 111卷 / 23期

关键词：

D O I：

10.1021/ja00205a003

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

引用

页码：8576 / 8582

页数：7

共 55 条

[1] CONFORMATIONAL ANALYSIS .57. CALCULATION OF CONFORMATIONAL STRUCTURES OF HYDROCARBONS BY WESTHEIMER-HENDRICKSON-WIBERG METHOD
ALLINGER, NL
MILLER, MA
VANCATLE.FA
HIRSCH, JA
[J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1967, 89 (17) : 4345 - &
[2] CONFORMATIONAL-ANALYSIS .130. MM2 - HYDROCARBON FORCE-FIELD UTILIZING V1 AND V2 TORSIONAL TERMS
ALLINGER, NL
[J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1977, 99 (25) : 8127 - 8134
[3] BENZENE, AROMATIC RINGS, VANDERWAALS MOLECULES, AND CRYSTALS OF AROMATIC-MOLECULES IN MOLECULAR MECHANICS (MM3)
ALLINGER, NL
LII, JH
[J]. JOURNAL OF COMPUTATIONAL CHEMISTRY, 1987, 8 (08) : 1146 - 1153
[4] ALLINGER NL, 1989, J AM CHEM S, V111
[5] FORCES IN BENZENE CRYSTAL .I. LATTICE ENERGY OF CRYSTALLINE BENZENE
BANERJEE, K
SALEM, L
[J]. MOLECULAR PHYSICS, 1966, 11 (05) : 405 - &
[6] VIBRATIONAL-SPECTRA AND DIHEDRAL ANGLES OF BIPHENYL AND 4,4-DIHALOGENOBIPHENYLS
BARRETT, RM
STEELE, D
[J]. JOURNAL OF MOLECULAR STRUCTURE, 1972, 11 (01) : 105 - &
[7] NATURE OF BONDS BETWEEN CARBON ATOMS HOW THEY VARY WITH ENVIRONMENT
BASTIANSEN, O
TRAETTEBERG, M
[J]. TETRAHEDRON, 1962, 17 (3-4) : 147 - &
[8] THE VAPOUR PRESSURE AND LATTICE ENERGY OF SOME AROMATIC RING COMPOUNDS
BRADLEY, RS
CLEASBY, TG
[J]. JOURNAL OF THE CHEMICAL SOCIETY, 1953, (JUN): : 1690 - 1692
[9] The crystal structure of hexamethylbenzene and the length of the methyl group bond to aromatic carbon atoms
Brockway, LO
Robertson, JM
[J]. JOURNAL OF THE CHEMICAL SOCIETY, 1939, : 1324 - 1332
[10] BURKERT U, 1982, MOL MECHANICS

← 1 2 3 4 5 6 →