LOCALIZED MO ANALYSIS OF THE 1,2-HYDROGEN SHIFT MECHANISM

被引：20

作者：

HA, TK ^{[1
]}

NGUYEN, MT ^{[1
]}

HENDRICKX, M ^{[1
]}

VANQUICKENBORNE, LG ^{[1
]}

机构：

[1] CATHOLIC UNIV LEUVEN,DEPT CHEM,B-3030 HEVERLE,BELGIUM

来源：

CHEMICAL PHYSICS LETTERS | 1983年 / 96卷 / 03期

关键词：

D O I：

10.1016/0009-2614(83)80669-1

中图分类号：

O64 [物理化学（理论化学）、化学物理学];

学科分类号：

070304 ; 081704 ;

摘要：

引用

页码：267 / 272

页数：6

共 20 条

[1] STEREOCHEMISTRY OF CARBENE REARRANGEMENTS - CORRELATION OF ABINITIO MOLECULAR-ORBITALS AS AN AID TO INVESTIGATION OF ELECTRON REDISTRIBUTION MECHANISM
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[2] ABINITIO STUDY OF STRUCTURES OF ETHYLIDENE
ALTMANN, JA
CSIZMADIA, IG
YATES, K
[J]. CHEMICAL PHYSICS LETTERS, 1976, 41 (03) : 500 - 502
[3] RELATIONSHIP OF CORRELATION-ENERGY AND SIZE
ANG, MH
YATES, K
CSIZMADIA, IG
DAUDEL, R
[J]. INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 1981, 20 (04) : 793 - 806
[4] BOYS SF, 1966, QUANTUM THEORY ATOMS, P253
[5] A THEORETICAL-STUDY OF THE ROLE OF VALENCE AND RYDBERG STATES IN THE PHOTOCHEMISTRY OF ETHYLENE
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SEVIN, A
[J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1981, 103 (25) : 7414 - 7422
[6] CANONICAL CONFIGURATIONAL INTERACTION PROCEDURE
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BOYS, SF
[J]. REVIEWS OF MODERN PHYSICS, 1960, 32 (02) : 300 - 302
[7] FOSTER JM, 1960, REV MOD PHYS, V32, P296
[8] LOCALIZED ORBITAL STUDY OF REARRANGEMENTS CH-3CH-]CH2=CH2 AND (CH-3)2C-]CH-3CH=CH-2
GORDON, MS
SAATZER, PM
KOOB, RD
[J]. CHEMICAL PHYSICS LETTERS, 1976, 37 (02) : 217 - 225
[9] ABINITIO CI STUDY ON THE SINGLET TRIPLET SEPARATION OF ETHYLIDENE, CH3CH
HA, TK
NGUYEN, MT
VANQUICKENBORNE, LG
[J]. CHEMICAL PHYSICS LETTERS, 1982, 92 (05) : 459 - 461
[10] ABINITIO STUDIES OF (1,2)-HYDROGEN MIGRATIONS IN OPEN-SHELL HYDROCARBONS - VINYL RADICAL, ETHYL RADICAL, AND TRIPLET METHYLCARBENE
HARDING, LB
[J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1981, 103 (25) : 7469 - 7475

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