ABINITIO STUDY OF THE ROTATIONAL ENERGY BARRIER IN CARBONYLYLIDE

被引:14
作者
JEAN, Y
VOLATRON, F
机构
关键词
D O I
10.1016/0009-2614(81)80296-5
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
收藏
页码:91 / 96
页数:6
相关论文
共 35 条
[1]  
ANH NT, UNPUBLISHED
[2]   ABINITIO SCF CALCULATIONS ON THE PHOTO-CHEMICAL BEHAVIOR OF THE 3-MEMBERED RINGS .3. OXIRANE - RING-OPENING [J].
BIGOT, B ;
SEVIN, A ;
DEVAQUET, A .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1979, 101 (05) :1095-1100
[3]  
DAHMEN A, 1971, CHEM COMMUN, P1191
[4]   SELF-CONSISTENT MOLECULAR-ORBITAL METHODS .9. EXTENDED GAUSSIAN-TYPE BASIS FOR MOLECULAR-ORBITAL STUDIES OF ORGANIC MOLECULES [J].
DITCHFIELD, R ;
HEHRE, WJ ;
POPLE, JA .
JOURNAL OF CHEMICAL PHYSICS, 1971, 54 (02) :724-+
[5]  
Do-Minh T., 1970, J AM CHEM SOC, V92, P1402
[6]   GENERATION OF CARBENES BY PHOTOCHEMICAL CYCLOELIMINATION [J].
GRIFFIN, GW .
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, 1971, 10 (08) :537-&
[7]  
HAMBERGER H, 1971, CHEM COMMUN, P1190
[8]   MECHANISMS OF GAS-PHASE AND LIQUID-PHASE OZONOLYSIS [J].
HARDING, LB ;
GODDARD, WA .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1978, 100 (23) :7180-7188
[9]   ELECTRONIC STRUCTURE OF OPEN FORMS OF 3-MEMBERED RINGS [J].
HAYES, EF ;
SIU, AKQ .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1971, 93 (08) :2090-&
[10]   LCAO-MO-SCF STUDIES OF CARBON-CARBON BOND CLEAVAGE IN ETHYLENE OXIDE [J].
HAYES, EF .
JOURNAL OF CHEMICAL PHYSICS, 1969, 51 (11) :4787-&