VARIATIONAL TRANSITION-STATE FOR THE REACTION OF CL2C - WITH ETHYLENE AND THE THERMODYNAMICS OF CARBENE ADDITIONS

被引：59

作者：

BLAKE, JF ^{[1
]}

WIERSCHKE, SG ^{[1
]}

JORGENSEN, WL ^{[1
]}

机构：

[1] PURDUE UNIV,DEPT CHEM,W LAFAYETTE,IN 47907

来源：

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY | 1989年 / 111卷 / 05期

关键词：

D O I：

10.1021/ja00187a078

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

引用

页码：1919 / 1920

页数：2

共 18 条

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[3] VARIATIONAL TRANSITION-STATE THEORY AND TUNNELING FOR A HEAVY LIGHT HEAVY REACTION USING AN ABINITIO POTENTIAL-ENERGY SURFACE - CL-37+H(D) CL-35-]H(D) CL-37+CL-35
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[5] Hehre W. J., 1986, AB INITIO MOL ORBITA
[6] ARE PI-COMPLEXES INTERMEDIATES IN HALOCARBENE CYCLO-ADDITIONS
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[7] ORIGIN OF NEGATIVE ACTIVATION-ENERGIES AND ENTROPY CONTROL OF HALOCARBENE CYCLO-ADDITIONS AND RELATED FAST REACTIONS
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RONDAN, NG
[J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1984, 106 (15) : 4293 - 4294
[8] THEORETICAL-STUDIES OF HALOCARBENE CYCLO-ADDITION SELECTIVITIES - A NEW INTERPRETATION OF NEGATIVE ACTIVATION-ENERGIES AND ENTROPY CONTROL OF SELECTIVITY
HOUK, KN
RONDAN, NG
MAREDA, J
[J]. TETRAHEDRON, 1985, 41 (08) : 1555 - 1563
[9] POLYATOMIC CANONICAL VARIATIONAL THEORY FOR CHEMICAL-REACTION RATES - SEPARABLE-MODE FORMALISM WITH APPLICATION TO OH+H2-]H2O+H
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[J]. JOURNAL OF CHEMICAL PHYSICS, 1982, 76 (03) : 1380 - 1391
[10] KREEVOY MM, 1986, INVESTIGATION RATES, V6, P13

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