QUANTITATIVE NON-EMPIRICAL ANALYSIS OF PI-CONJUGATIVE EFFECTS OF SUBSTITUENTS

被引：27

作者：

BERNARDI, F ^{[1
]}

BOTTONI, A ^{[1
]}

EPIOTIS, ND ^{[1
]}

机构：

[1] UNIV WASHINGTON,DEPT CHEM,SEATTLE,WA 98195

来源：

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY | 1978年 / 100卷 / 23期

关键词：

D O I：

10.1021/ja00491a014

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

引用

页码：7205 / 7209

页数：5

共 10 条

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[2] QUANTUM ORGANIC PHOTOCHEMISTRY .1. INTRAMOLECULAR POTENTIAL ENERGY SURFACES FOR LOWEST 3-PI-PI] STATE OF POLYENES
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[J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1971, 93 (18) : 4427 - &
[3] PI DONATING ABILITY OF HETEROATOMS
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[J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1977, 99 (23) : 7465 - 7470
[4] QUANTITATIVE NON-EMPIRICAL ESTIMATES OF EFFECTS OF ORBITAL INTERACTIONS - APPLICATIONS TO DIFLUOROETHYLENES
BERNARDI, F
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GUERRA, M
[J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1978, 100 (19) : 6018 - 6022
[5] Dewar M.J.S., 1969, MOL ORBITAL THEORY O
[6] SELF-CONSISTENT MOLECULAR-ORBITAL METHODS .9. EXTENDED GAUSSIAN-TYPE BASIS FOR MOLECULAR-ORBITAL STUDIES OF ORGANIC MOLECULES
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[J]. JOURNAL OF CHEMICAL PHYSICS, 1971, 54 (02) : 724 - +
[7] HEHRE WJ, GAUSSIAN 70
[8] METHOD FOR EVALUATION OF INDUCTIVE AND CONJUGATIVE EFFECTS - APPLICATION TO TROPONE
MULLER, C
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[J]. ANGEWANDTE CHEMIE-INTERNATIONAL EDITION IN ENGLISH, 1974, 13 (04): : 273 - 273
[9] SLOW INVERSION AT PYRAMIDAL BONDED NITROGEN - CONFIGURATION AND CONFORMATION AT STRUCTURE TYPE N,N-DIALKOXY-ALKYLAMINE FROM VIEWING SEMIEMPIRICAL MOLECULAR-ORBITAL-MODEL
MULLER, K
[J]. HELVETICA CHIMICA ACTA, 1970, 53 (05) : 1112 - &
[10] MOLECULAR-ORBITALS FROM GROUP ORBITALS .3. QUANTITATIVE PERTURBATIONAL MOLECULAR-ORBITAL ANALYSIS OF ABINITIO SCF-MO WAVE-FUNCTIONS
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[J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1977, 99 (05) : 1296 - 1304

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