MOLECULAR MECHANICS CALCULATIONS ON CONJUGATED NITROGEN-CONTAINING HETEROCYCLES

被引：83

作者：

TAI, JC

ALLINGER, NL

机构：

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

[2] UNIV MICHIGAN,DEPT MED 3,DEARBORN,MI 48128

来源：

关键词：

D O I：

10.1021/ja00215a006

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

引用

页码：2050 / 2055

页数：6

共 49 条

[21] CRITICAL EVALUATION OF MOLECULAR MECHANICS
ENGLER, EM
ANDOSE, JD
SCHLEYER, PV
[J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1973, 95 (24) : 8005 - 8025
[22] Ermer O., 1976, STRUCT BONDING BERLI, V27, P161
[23] MOLECULAR-STRUCTURE OF GASEOUS PYRIMIDINE
FERNHOLT, L
ROMMING, C
[J]. ACTA CHEMICA SCANDINAVICA SERIES A-PHYSICAL AND INORGANIC CHEMISTRY, 1978, 32 (03): : 271 - 273
[24] EFFECT OF SUBSTITUTION ON PYRIMIDINE - CRYSTAL-STRUCTURES OF PYRIMIDINE AND ITS 5-METHYL, 2-CHLORO AND 2-AMINO DERIVATIVES
FURBERG, S
GROGAARD, J
SMEDSRUD, B
[J]. ACTA CHEMICA SCANDINAVICA SERIES B-ORGANIC CHEMISTRY AND BIOCHEMISTRY, 1979, 33 (10): : 715 - 724
[25] INFRARED-SPECTRUM OF METHYLENIMINE
JACOX, ME
MILLIGAN, DE
[J]. JOURNAL OF MOLECULAR SPECTROSCOPY, 1975, 56 (03) : 333 - 356
[26] THE MOLECULAR-STRUCTURE OF NAPHTHALENE BY ELECTRON-DIFFRACTION
KETKAR, SN
FINK, M
[J]. JOURNAL OF MOLECULAR STRUCTURE, 1981, 77 (1-2) : 139 - 147
[27] THEORETICAL CONFORMATIONAL ANALYSIS .4. AN AB-INITIO SCF-LCAO-MO STUDY OF METHYLENIMINE AND OF VINYL ANION
LEHN, JM
MUNSCH, B
MILLIE, P
[J]. THEORETICA CHIMICA ACTA, 1970, 16 (05): : 351 - &
[28] ON THE OUT-OF-PLANE DEFORMATION OF AROMATIC RINGS, AND ITS REPRESENTATION BY MOLECULAR MECHANICS
LILJEFORS, T
TAI, JC
LI, SS
ALLINGER, NL
[J]. JOURNAL OF COMPUTATIONAL CHEMISTRY, 1987, 8 (07) : 1051 - 1056
[29] LO DH, 1968, CAN J CHEM, V46, P2037
[30] MCCLELLAN A, 1973, TABLES EXPT DIPOLE M, V2