ISSN:
0020-7608
Keywords:
Computational Chemistry and Molecular Modeling
;
Atomic, Molecular and Optical Physics
Source:
Wiley InterScience Backfile Collection 1832-2000
Topics:
Chemistry and Pharmacology
Notes:
In the present article, polymethine and annulene electronic spectra are described in a unique way by means of the Pariser-Parr-Pople method. The analytical expressions were derived for the first π-electron transitions energies. The character of the annulene spectra, like the character of the open-chain spectra, was shown to be dependent on the ratio between electron and site numbers. The Dahne's triad theory and the existence of finite energy gap in polymethines are discussed. © 1996 John Wiley & Sons, Inc.
Additional Material:
1 Ill.
Type of Medium:
Electronic Resource
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