THE ELECTRONIC-SPECTRA OF BENZO[B]THIETE AND TRANSIENT ORTHO-THIOBENZOQUINONEMETHIDE - SPECTRAL ASSIGNMENTS ON THE BASIS OF THE ELECTRONIC-SPECTRA OF ANILINE, THIOPHENOL, THIOANISOLE, ALL-TRANS-OCTATETRAENE AND TRANSIENT ORTHO-XYLYLENE IN CONJUNCTION WITH QUANTUM-CHEMICAL CALCULATIONS

被引：11

作者：

SCHWEIG, A

DIEHL, F

KESPER, K

MEYER, H

机构：

来源：

JOURNAL OF MOLECULAR STRUCTURE | 1989年 / 198卷

关键词：

D O I：

10.1016/0022-2860(89)80046-8

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

页码：307 / 325

页数：19

共 58 条

[1] (ALL-E)-1,3,5,7-OCTATETRAENE - ELECTRON-ENERGY-LOSS AND ELECTRON-TRANSMISSION SPECTRA [J].

ALLAN, M ;

NEUHAUS, L ;

HASELBACH, E .

HELVETICA CHIMICA ACTA, 1984, 67 (07) :1776-1782

[2] ORGANIC QUANTUM CHEMISTRY .9. ULTRAVIOLET SPECTRA OF UNSATURATED HYDROCARBONS . WOODWARDS RULES [J].

ALLINGER, NL ;

TAI, JC .

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1965, 87 (10) :2081-&

[3] INCOMPLETE ELECTRONICONFIGURATIONS .5. ELECTRON STRUCTURE OF SOME BIRADICAL HYDROCARBONS [J].

BAUDET, J .

JOURNAL DE CHIMIE PHYSIQUE ET DE PHYSICO-CHIMIE BIOLOGIQUE, 1971, 68 (02) :191-&

[4] [2N]CYCLOPHANES - PARACYCLOPHANE TO SUPERPHANE [J].

BOEKELHEIDE, V .

ACCOUNTS OF CHEMICAL RESEARCH, 1980, 13 (03) :65-70

[5] ABINITIO INVESTIGATION OF SEVERAL LOW-LYING STATES OF ALL-TRANS-OCTATETRAENE [J].

CAVE, RJ ;

DAVIDSON, ER .

JOURNAL OF PHYSICAL CHEMISTRY, 1988, 92 (08) :2173-2177

[6]

DELBENE J, 1968, J CHEM PHYS, V48, P4050

[7] USE OF CNDO METHOD IN SPECTROSCOPY .3. MONOSUBSTITUTED BENZENES AND PYRIDINES [J].

DELBENE, J ;

JAFFE, HH .

JOURNAL OF CHEMICAL PHYSICS, 1968, 49 (03) :1221-&

[8]

DELBENE J, 1968, J CHEM PHYS, V48, P1807

[9] GROUND-STATES OF MOLECULES .38. MNDO METHOD - APPROXIMATIONS AND PARAMETERS [J].

DEWAR, MJS ;

THIEL, W .

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1977, 99 (15) :4899-4907

[10] 2-PHOTON SPECTROSCOPY OF DIPOLE-FORBIDDEN TRANSITIONS .1. DIPOLE-FORBIDDEN TRANSITIONS AND DOUBLE EXCITED CONFIGURATIONS IN THE CNDO-CI METHODS [J].

DICK, B ;

HOHLNEICHER, G .

THEORETICA CHIMICA ACTA, 1979, 53 (03) :221-251

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