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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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