THE STABILITY OF FLUOROVINYLIDENE AND DIFLUOROVINYLIDENE

被引:84
作者
FRISCH, MJ [1 ]
KRISHNAN, R [1 ]
POPLE, JA [1 ]
SCHLEYER, PV [1 ]
机构
[1] UNIV ERLANGEN NURNBERG,INST ORGAN CHEM,D-8520 ERLANGEN,FED REP GER
关键词
D O I
10.1016/0009-2614(81)85642-4
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:421 / 423
页数:3
相关论文
共 15 条
[1]  
APELOIG Y, 1978, TETRAHEDRON LETT, P4555
[2]   SELF-CONSISTENT MOLECULAR-ORBITAL METHODS .21. SMALL SPLIT-VALENCE BASIS-SETS FOR 1ST-ROW ELEMENTS [J].
BINKLEY, JS ;
POPLE, JA ;
HEHRE, WJ .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1980, 102 (03) :939-947
[3]   VINYLIDENE-ACETYLENE REARRANGEMENT - SELF-CONSISTENT ELECTRON PAIRS STUDY OF A MODEL UNIMOLECULAR REACTION [J].
DYKSTRA, CE ;
SCHAEFER, HF .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1978, 100 (05) :1378-1382
[4]   ACCURACY OF AH EQUILIBRIUM GEOMETRIES BY SINGLE DETERMINANT MOLECULAR-ORBITAL THEORY [J].
HARIHARAN, PC ;
POPLE, JA .
MOLECULAR PHYSICS, 1974, 27 (01) :209-214
[5]   THE VINYLIDENE-ACETYLENE ISOMERIZATION BARRIER [J].
KRISHNAN, R ;
FRISCH, MJ ;
POPLE, JA ;
SCHLEYER, PV .
CHEMICAL PHYSICS LETTERS, 1981, 79 (03) :408-411
[6]   APPROXIMATE 4TH-ORDER PERTURBATION-THEORY OF ELECTRON CORRELATION ENERGY [J].
KRISHNAN, R ;
POPLE, JA .
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 1978, 14 (01) :91-100
[7]   MERCURY-6(P-3(I)) PHOTOSENSITIZATION OF TRIFLUOROETHYLENE - SOURCE OF DIFLUOROVINYLIDENE CARBENE [J].
NORSTROM, RJ ;
GUNNING, HE ;
STRAUSZ, OP .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1976, 98 (06) :1454-1461
[8]   ELECTRON CORRELATION THEORIES AND THEIR APPLICATION TO STUDY OF SIMPLE REACTION POTENTIAL SURFACES [J].
POPLE, JA ;
KRISHNAN, R ;
SCHLEGEL, HB ;
BINKLEY, JS .
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 1978, 14 (05) :545-560
[9]  
POPLE JA, 1979, INT J QUANTUM CHEM, V13, P255
[10]   MOLECULAR ORBITAL THEORY OF ELECTRONIC STRUCTURE OF ORGANIC COMPOUNDS .8. GEOMETRIES, ENERGIES, AND POLARITIES OF C3 HYDROCARBONS [J].
RADOM, L ;
LATHAN, WA ;
HEHRE, WJ ;
POPLE, JA .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1971, 93 (21) :5339-&