WHY IS AZULENE BLUE AND ANTHRACENE WHITE - SIMPLE MO PICTURE

被引：181

作者：

MICHL, J ^{[1
]}

THULSTRUP, EW ^{[1
]}

机构：

[1] UNIV UTAH,DEPT CHEM,SALT LAKE CITY,UT 84112

来源：

TETRAHEDRON | 1976年 / 32卷 / 02期

关键词：

D O I：

10.1016/0040-4020(76)87002-0

中图分类号：

O62 [有机化学];

学科分类号：

070303 ; 081704 ;

摘要：

引用

页码：205 / 209

页数：5

共 19 条

[1] HUNDS RULES AND INTERPRETATION AND COMMON MISINTERPRETATION OF ENERGY DIFFERENCES [J].

COLPA, JP ;

BROWN, RE .

MOLECULAR PHYSICS, 1973, 26 (06) :1453-1463

[2]

Coulson CA, 1940, P CAMB PHILOS SOC, V36, P193

[3] ALKYL SHIFTS IN ABSORPTION SPECTRA OF AZULENE AND OTHER AROMATIC MOLECULES [J].

COULSON, CA .

PROCEEDINGS OF THE PHYSICAL SOCIETY OF LONDON SECTION A, 1952, 65 (395) :933-945

[4]

DEWAR MJS, 1969, MOLECULAR ORBITAL TH, P62

[5]

GERSON F, 1971, NONBENZENOID AROMATI, V2, P81

[6] PREDICTION OF SPECTRA OF AROMATIC HYDROCARBONS [J].

HEILBRONN, E ;

MURRELL, JN .

JOURNAL OF THE CHEMICAL SOCIETY, 1962, (JUL) :2611-&

[7]

HEILBRONNER E, 1959, NONBENZENOID AROMATI, P185

[8] SINGLET-TRIPLET EXPECTATION VALUE DIFFERENCES FOR 2-ELECTRON IONS [J].

KILLINGBECK, J .

MOLECULAR PHYSICS, 1973, 25 (02) :455-459

[9]

Koopmans T.A., 1934, PHYSICA, V1, P104, DOI DOI 10.1016/S0031-8914(34)90011-2

[10] CALCULATION OF ELECTRONIC SPECTRA OF NONALTERNANT CONJUGATED HYDROCARBONS BY SEMIEMPIRICAL METHOD OF LIMITED CONFIGURATION INTERACTION [J].

KOUTECKY, J ;

HOCHMAN, P ;

MICHL, J .

JOURNAL OF CHEMICAL PHYSICS, 1964, 40 (09) :2439-&

← 1 2 →