Electronic absorption spectra and dipole moments of diazafluoren-9-ones studied by the MIM, PPP, and CNDO/2 methods
作者:
Concetta Gandolfo,
Giuseppe Buemi,
Domenico Grasso,
Salvatore Fasone,
期刊:
Canadian Journal of Chemistry
(NRC Available online 1976)
卷期:
Volume 54,
issue 12
页码: 1870-1874
ISSN:0008-4042
年代: 1976
DOI:10.1139/v76-266
出版商: NRC Research Press
数据来源: NRC
摘要:
The electronic spectra of three diazafluoren-9-one isomers have been measured in cyclohexane solution and the results compared with those of 'molecules in molecules'(MIM) and PPP calculations. A satisfactory agreement between experimental and theoretical data has been found, and five π → π* transitions can be assigned to their uv spectra. For two compounds dipole moments in benzene solution have been measured and results are compared with theoretical values obtained by MIM and CNDO/2 calculations.
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