SCF MOLECULAR-ORBITALS AND PHOTOELECTRON-SPECTRUM OF 5,5-DIMETHYL-DELTA-3-1,3,4-OXADIAZOLIN-2-ONE

被引:3
作者
PAINE, AJ
WERSTIUK, NH
机构
来源
CANADIAN JOURNAL OF CHEMISTRY-REVUE CANADIENNE DE CHIMIE | 1978年 / 56卷 / 10期
关键词
D O I
10.1139/v78-219
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
引用
收藏
页码:1319 / 1326
页数:8
相关论文
共 33 条
[1]  
ALPERT NL, 1970, IR THEORY PRACTICE I
[2]  
[Anonymous], 1954, B CHEM SOC JPN
[3]  
BAIN AD, 1972, THESIS U BRIT COLUMB
[4]   MOLECULAR-CONFORMATION AND ELECTRONIC-STRUCTURE .3. CRYSTAL AND MOLECULAR-STRUCTURE OF STABLE FORM OF N-(PARA-CHLOROBENZYLIDENE)-PARA-CHLOROANILINE [J].
BERNSTEIN, J ;
IZAK, I .
JOURNAL OF THE CHEMICAL SOCIETY-PERKIN TRANSACTIONS 2, 1976, (04) :429-434
[5]  
BERTHIER G, 1970, CHEM CARBONYL GROUP, pCH1
[6]   Ionization potentials by the CNDO/2 method [J].
Davies, D. W. .
CHEMICAL PHYSICS LETTERS, 1968, 2 (03) :173-175
[7]   The ionization potentials of methyl cyanide and methyl acetylene by photoelectron spectroscopy and semi-rigorous LCAOSCF calculations [J].
Frost, D. C. ;
Herring, F. G. ;
McDowell, C. A. ;
Stenhouse, I. A. .
CHEMICAL PHYSICS LETTERS, 1970, 4 (09) :533-536
[8]   PREPARATION AND FATE OF CARBON MONOSULFIDE (CS) - ULTRAVIOLET PHOTOELECTRON SPECTROSCOPIC STUDY OF THERMOLYSIS OF 5,5-DIMETHYL-1-PHENYL-DELTA-3-1,3,4-TRIAZOLINE-2-THIONE [J].
FROST, DC ;
WESTWOOD, NPC ;
WERSTIUK, NH ;
CABELKOVATAGUCHI, L ;
WARKENTIN, J .
CANADIAN JOURNAL OF CHEMISTRY-REVUE CANADIENNE DE CHIMIE, 1977, 55 (21) :3677-3680
[9]   MO-THEORETICAL APPROACH TO THE MECHANISM OF CHARGE TRANSFER IN THE PROCESS OF AROMATIC SUBSTITUTIONS [J].
FUKUI, K ;
YONEZAWA, T ;
NAGATA, C .
JOURNAL OF CHEMICAL PHYSICS, 1957, 27 (06) :1247-1259
[10]   CORRELATION BETWEEN PHOTOELECTRON AND ELECTRONIC SPECTRA IN TRANS-AZOMETHANE [J].
HASELBACH, E ;
SCHMELZE.A .
HELVETICA CHIMICA ACTA, 1971, 54 (06) :1575-+