CONFORMATIONAL-ANALYSIS .130. MM2 - HYDROCARBON FORCE-FIELD UTILIZING V1 AND V2 TORSIONAL TERMS

被引:4399
作者
ALLINGER, NL [1 ]
机构
[1] UNIV GEORGIA,DEPT CHEM,ATHENS,GA 30602
关键词
D O I
10.1021/ja00467a001
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
引用
收藏
页码:8127 / 8134
页数:8
相关论文
共 38 条
[1]   STRUCTURE, EQUILIBRIUM CONFORMATION, AND PSEUDOROTATION IN CYCLOPENTANE - AN ELECTRON DIFFRACTION STUDY [J].
ADAMS, WJ ;
GEISE, HJ ;
BARTELL, LS .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1970, 92 (17) :5013-&
[2]   CONFORMATIONAL ANALYSIS .57. CALCULATION OF CONFORMATIONAL STRUCTURES OF HYDROCARBONS BY WESTHEIMER-HENDRICKSON-WIBERG METHOD [J].
ALLINGER, NL ;
MILLER, MA ;
VANCATLE.FA ;
HIRSCH, JA .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1967, 89 (17) :4345-&
[3]   CONFORMATIONAL ANALYSIS .60. IMPROVED CALCULATIONS OF STRUCTURES AND ENERGIES OF HYDROCARBONS BY WESTHEIMER METHOD [J].
ALLINGER, NL ;
HIRSCH, JA ;
MILLER, MA ;
TYMINSKI, IJ ;
VANCATLE.FA .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1968, 90 (05) :1199-&
[4]   CONFORMATIONAL-ANALYSIS .125. IMPORTANCE OF TWOFOLD BARRIERS IN SATURATED MOLECULES [J].
ALLINGER, NL ;
HINDMAN, D ;
HONIG, H .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1977, 99 (10) :3282-3284
[5]   CONFORMATIONAL-ANALYSIS .118. APPLICATION OF MOLECULAR-MECHANICS METHOD TO ALCOHOLS AND ETHERS [J].
ALLINGER, NL ;
CHUNG, DY .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1976, 98 (22) :6798-6803
[6]  
ALTONA C, 1974, TOP CURR CHEM, V45, P1
[7]  
ANET FAL, 1975, DYNAMIC NUCLEAR MAGN, P543
[8]  
[Anonymous], 1976, ADV PHYS ORG CHEM
[9]   REPRESENTATIONS OF MOLECULAR-FORCE FIELDS .3. GAUCHE CONFORMATIONAL ENERGY [J].
BARTELL, LS .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1977, 99 (10) :3279-3282
[10]   STRUCTURE AND ROTATIONAL ISOMERIZATION OF FREE HYDROCARBON CHAINS [J].
BARTELL, LS ;
KOHL, DA .
JOURNAL OF CHEMICAL PHYSICS, 1963, 39 (11) :3097-&