ABINITIO HEATS OF FORMATION OF MEDIUM-SIZED HYDROCARBONS .3. THE VALENCE ISOMERS OF BENZENE

被引:63
作者
SCHULMAN, JM
DISCH, RL
机构
关键词
D O I
10.1021/ja00304a007
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
引用
收藏
页码:5059 / 5061
页数:3
相关论文
共 29 条
[1]   THE STRUCTURES AND ENERGIES OF SOME UNSATURATED 4-MEMBERED RING CARBOCYCLES [J].
ALLINGER, NL ;
YUH, Y ;
SPRAGUE, JT .
JOURNAL OF COMPUTATIONAL CHEMISTRY, 1980, 1 (01) :30-35
[2]   REINVESTIGATION OF THE MOLECULAR STRUCTURE OF 1,3,5,7-CYCLOOCTATETRAENE BY ELECTRON DIFFRACTION [J].
BASTIANSEN, O ;
HEDBERG, L ;
HEDBERG, K .
JOURNAL OF CHEMICAL PHYSICS, 1957, 27 (06) :1311-1317
[3]  
BEWS JR, 1982, J MOL STRUC-THEOCHEM, V86, P197
[4]  
COX JD, 1970, THERMOCHEMISTRY ORGA
[5]  
DAI Y, 1984, J MOL STRUC-THEOCHEM, V109, P127
[6]   ABINITIO HEATS OF FORMATION OF MEDIUM-SIZED HYDROCARBONS .2. USE OF 2ND-ORDER CORRELATION ENERGIES [J].
DISCH, RL ;
SCHULMAN, JM ;
SABIO, ML .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1985, 107 (07) :1904-1906
[7]   PREDICTION OF HEAT AND FREE ENERGIES OF ORGANIC COMPOUNDS [J].
FRANKLIN, JL .
INDUSTRIAL AND ENGINEERING CHEMISTRY, 1949, 41 (05) :1070-1076
[8]   COMPARISON OF VARIOUS ISODESMIC AND HOMODESMOTIC REACTION HEATS WITH VALUES DERIVED FROM PUBLISHED ABINITIO MOLECULAR-ORBITAL CALCULATIONS [J].
GEORGE, P ;
TRACHTMAN, M ;
BRETT, AM ;
BOCK, CW .
JOURNAL OF THE CHEMICAL SOCIETY-PERKIN TRANSACTIONS 2, 1977, (08) :1036-1047
[9]   ALTERNATIVE APPROACH TO PROBLEM OF ASSESSING DESTABILIZATION ENERGIES (STRAIN ENERGIES) IN CYCLIC HYDROCARBONS [J].
GEORGE, P ;
TRACHTMAN, M ;
BOCK, CW ;
BRETT, AM .
TETRAHEDRON, 1976, 32 (03) :317-323
[10]   3,3'-BICYCLOPROPENYL - EVIDENCE FOR NOVEL LONG-RANGE CONJUGATION OF PI-ORBITALS [J].
GREENBERG, A ;
LIEBMAN, JF .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1981, 103 (01) :44-48