共 41 条
Direct dynamics study of the stereomutation of cyclopropane
被引:89
作者:

Doubleday, C
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机构:
WAYNE STATE UNIV,DEPT CHEM,DETROIT,MI 48202 WAYNE STATE UNIV,DEPT CHEM,DETROIT,MI 48202

Bolton, K
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机构:
WAYNE STATE UNIV,DEPT CHEM,DETROIT,MI 48202 WAYNE STATE UNIV,DEPT CHEM,DETROIT,MI 48202

Hase, WL
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h-index: 0
机构:
WAYNE STATE UNIV,DEPT CHEM,DETROIT,MI 48202 WAYNE STATE UNIV,DEPT CHEM,DETROIT,MI 48202
机构:
[1] WAYNE STATE UNIV,DEPT CHEM,DETROIT,MI 48202
关键词:
D O I:
10.1021/ja964250k
中图分类号:
O6 [化学];
学科分类号:
0703 ;
摘要:
引用
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页码:5251 / 5252
页数:2
相关论文
共 41 条
[11]
MOLECULAR-DYNAMICS WITH COMBINED QUANTUM AND EMPIRICAL POTENTIALS - C2H2 ADSORPTION ON SI(100)
[J].
CARMER, CS
;
WEINER, B
;
FRENKLACH, M
.
JOURNAL OF CHEMICAL PHYSICS,
1993, 99 (02)
:1356-1372

CARMER, CS
论文数: 0 引用数: 0
h-index: 0
机构:
PENN STATE UNIV,DEPT PHYS,DU BOIS,PA 15801 PENN STATE UNIV,DEPT PHYS,DU BOIS,PA 15801

WEINER, B
论文数: 0 引用数: 0
h-index: 0
机构:
PENN STATE UNIV,DEPT PHYS,DU BOIS,PA 15801 PENN STATE UNIV,DEPT PHYS,DU BOIS,PA 15801

FRENKLACH, M
论文数: 0 引用数: 0
h-index: 0
机构:
PENN STATE UNIV,DEPT PHYS,DU BOIS,PA 15801 PENN STATE UNIV,DEPT PHYS,DU BOIS,PA 15801
[12]
INTRAMOLECULAR DYNAMICS FOR THE ORGANIC CHEMIST
[J].
CARPENTER, BK
.
ACCOUNTS OF CHEMICAL RESEARCH,
1992, 25 (11)
:520-528

CARPENTER, BK
论文数: 0 引用数: 0
h-index: 0
机构: Department of Chemistry, Baker Laboratory, Cornell University, New York, Ithaca
[13]
DYNAMIC MATCHING - THE CAUSE OF INVERSION OF CONFIGURATION IN THE [1,3] SIGMATROPIC MIGRATION
[J].
CARPENTER, BK
.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1995, 117 (23)
:6336-6344

CARPENTER, BK
论文数: 0 引用数: 0
h-index: 0
机构: Department of Chemistry, Baker Laboratory, Cornell University, Ithaca
[14]
Bimodal distribution of lifetimes for an intermediate from a quasiclassical dynamics simulation
[J].
Carpenter, BK
.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1996, 118 (42)
:10329-10330

Carpenter, BK
论文数: 0 引用数: 0
h-index: 0
机构: Department of Chemistry, Baker Laboratory, Cornell University, Ithaca
[15]
DYNAMICAL STUDY OF MECHANISTIC DETAILS IN ORGANIC REACTIONS .2. OVERALL STUDY OF ISOMERIZATIONS OF CYCLOPROPANE
[J].
CHAPUISAT, X
;
JEAN, Y
.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1975, 97 (22)
:6325-6337

CHAPUISAT, X
论文数: 0 引用数: 0
h-index: 0
机构: CNRS,LAB CHIM THEORIQUE,ORSAY,FRANCE

JEAN, Y
论文数: 0 引用数: 0
h-index: 0
机构: CNRS,LAB CHIM THEORIQUE,ORSAY,FRANCE
[16]
TRAJECTORY STUDIES OF SN2 NUCLEOPHILIC-SUBSTITUTION .2. NONSTATISTICAL CENTRAL BARRIER RECROSSING IN THE CL(-)+CH3CL SYSTEM
[J].
CHO, YJ
;
VANDELINDE, SR
;
ZHU, L
;
HASE, WL
.
JOURNAL OF CHEMICAL PHYSICS,
1992, 96 (11)
:8275-8287

CHO, YJ
论文数: 0 引用数: 0
h-index: 0
机构: Department of Chemistry, Wayne State University, Detroit

VANDELINDE, SR
论文数: 0 引用数: 0
h-index: 0
机构: Department of Chemistry, Wayne State University, Detroit

ZHU, L
论文数: 0 引用数: 0
h-index: 0
机构: Department of Chemistry, Wayne State University, Detroit

HASE, WL
论文数: 0 引用数: 0
h-index: 0
机构: Department of Chemistry, Wayne State University, Detroit
[17]
RACEMIZATION AND GEOMETRICAL ISOMERIZATION OF (2S,3S)-CYCLOPROPANE-1-C-13-1,2,3-D3 AT 407-DEGREES-C - KINETICALLY COMPETITIVE ONE-CENTER AND 2-CENTER THERMAL EPIMERIZATIONS IN AN ISOTOPICALLY SUBSTITUTED CYCLOPROPANE
[J].
CIANCIOSI, SJ
;
RAGUNATHAN, N
;
FREEDMAN, TB
;
NAFIE, LA
;
LEWIS, DK
;
GLENAR, DA
;
BALDWIN, JE
.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1991, 113 (05)
:1864-1866

CIANCIOSI, SJ
论文数: 0 引用数: 0
h-index: 0
机构: SYRACUSE UNIV,DEPT CHEM,SYRACUSE,NY 13244

RAGUNATHAN, N
论文数: 0 引用数: 0
h-index: 0
机构: SYRACUSE UNIV,DEPT CHEM,SYRACUSE,NY 13244

FREEDMAN, TB
论文数: 0 引用数: 0
h-index: 0
机构: SYRACUSE UNIV,DEPT CHEM,SYRACUSE,NY 13244

NAFIE, LA
论文数: 0 引用数: 0
h-index: 0
机构: SYRACUSE UNIV,DEPT CHEM,SYRACUSE,NY 13244

LEWIS, DK
论文数: 0 引用数: 0
h-index: 0
机构: SYRACUSE UNIV,DEPT CHEM,SYRACUSE,NY 13244

GLENAR, DA
论文数: 0 引用数: 0
h-index: 0
机构: SYRACUSE UNIV,DEPT CHEM,SYRACUSE,NY 13244

BALDWIN, JE
论文数: 0 引用数: 0
h-index: 0
机构: SYRACUSE UNIV,DEPT CHEM,SYRACUSE,NY 13244
[18]
THE DEVELOPMENT AND USE OF QUANTUM-MECHANICAL MOLECULAR-MODELS .76. AM1 - A NEW GENERAL-PURPOSE QUANTUM-MECHANICAL MOLECULAR-MODEL
[J].
DEWAR, MJS
;
ZOEBISCH, EG
;
HEALY, EF
;
STEWART, JJP
.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1985, 107 (13)
:3902-3909

DEWAR, MJS
论文数: 0 引用数: 0
h-index: 0

ZOEBISCH, EG
论文数: 0 引用数: 0
h-index: 0

HEALY, EF
论文数: 0 引用数: 0
h-index: 0

STEWART, JJP
论文数: 0 引用数: 0
h-index: 0
[19]
SINGLET BIRADICALS AS INTERMEDIATES - CANONICAL VARIATIONAL TRANSITION-STATE THEORY RESULTS FOR TRIMETHYLENE
[J].
DOUBLEDAY, C
;
MCIVER, JW
;
PAGE, M
.
JOURNAL OF PHYSICAL CHEMISTRY,
1988, 92 (15)
:4367-4371

DOUBLEDAY, C
论文数: 0 引用数: 0
h-index: 0
机构: SUNY BUFFALO,DEPT CHEM,BUFFALO,NY 14214

MCIVER, JW
论文数: 0 引用数: 0
h-index: 0
机构: SUNY BUFFALO,DEPT CHEM,BUFFALO,NY 14214

PAGE, M
论文数: 0 引用数: 0
h-index: 0
机构: SUNY BUFFALO,DEPT CHEM,BUFFALO,NY 14214
[20]
Tetramethylene optimized by MRCI and by CASSCF with a multiply polarized basis set
[J].
Doubleday, C
.
JOURNAL OF PHYSICAL CHEMISTRY,
1996, 100 (37)
:15083-15086

Doubleday, C
论文数: 0 引用数: 0
h-index: 0
机构: Department of Chemistry, Columbia University, New York