ABINITIO STUDIES OF STRUCTURAL FEATURES NOT EASILY AMENABLE TO EXPERIMENT .25. CONFORMATIONAL-ANALYSIS OF METHYL PROPANOATE AND COMPARISON WITH THE METHYL-ESTER OF GLYCINE

被引：14

作者：

KLIMKOWSKI, VJ

SCARSDALE, JN

SCHAFER, L

机构：

来源：

JOURNAL OF COMPUTATIONAL CHEMISTRY | 1983年 / 4卷 / 04期

关键词：

D O I：

10.1002/jcc.540040407

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

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页码：494 / 498

页数：5

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[1] BURGESS AW, 1974, ISRAEL J CHEM, V12, P239
[2] TILT AND ASYMMETRY OF METHYL-GROUPS IN ASYMMETRIC ENVIRONMENTS
FLOOD, E
PULAY, P
BOGGS, JE
[J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1977, 99 (17) : 5570 - 5574
[3] MOLECULAR-ORBITAL CONSTRAINED ELECTRON-DIFFRACTION STUDIES .4. CONFORMATIONAL-ANALYSIS OF THE METHYL-ESTER OF GLYCINE
KLIMKOWSKI, VJ
EWBANK, JD
VANALSENOY, C
SCARSDALE, JN
SCHAFER, L
[J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1982, 104 (06) : 1476 - 1480
[4] LEWIS PN, 1973, ISR J CHEM, V11, P121
[5] INDIVIDUAL CH BOND STRENGTHS IN SIMPLE ORGANIC-COMPOUNDS - EFFECTS OF CONFORMATION AND SUBSTITUTION
MCKEAN, DC
[J]. CHEMICAL SOCIETY REVIEWS, 1978, 7 (03) : 399 - 422
[6] MCKEAN DC, ACCTS CHEM RES
[7] A THEORETICAL APPROACH TO SUBSTITUENT EFFECTS - STRUCTURAL CONSEQUENCES OF METHYL HYPERCONJUGATION - METHYL-TILT ANGLES AND C-H BOND LENGTHS
PROSS, A
RADOM, L
RIGGS, NV
[J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1980, 102 (07) : 2253 - 2259
[8] AB INITIO CALCULATION OF FORCE CONSTANTS AND EQUILIBRIUM GEOMETRIES IN POLYATOMIC MOLECULES .I. THEORY
PULAY, P
[J]. MOLECULAR PHYSICS, 1969, 17 (02) : 197 - &
[9] EFFICIENT ABINITIO GRADIENT PROGRAM
PULAY, P
[J]. THEORETICA CHIMICA ACTA, 1979, 50 (04): : 299 - 312
[10] SYSTEMATIC ABINITIO GRADIENT CALCULATION OF MOLECULAR GEOMETRIES, FORCE CONSTANTS, AND DIPOLE-MOMENT DERIVATIVES
PULAY, P
FOGARASI, G
PANG, F
BOGGS, JE
[J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1979, 101 (10) : 2550 - 2560