π-Donor substituent effects on calculated structures, spin properties, and vibrations of radical anions of p-chloranil, p-fluoranil, and p-benzoquinone

Journal of Physical Chemistry A

Volumn 101, Issue 44, 1997, Pages 8351-8359

  Boesch, Scott E ^a   Wheeler, Ralph A ^a  

^a UNIVERSITY OF OKLAHOMA   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

CHARGE TRANSFER; CHEMICAL BONDS; COMPUTATIONAL METHODS; ELECTRONIC PROPERTIES; MOLECULAR SPECTROSCOPY; MOLECULAR STRUCTURE; MOLECULAR VIBRATIONS;

BENZOQUINONE; DENSITY FUNCTIONAL THEORY; HARTREE FOCK THEORY;

AROMATIC COMPOUNDS;

EID: 0031247350     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp9719974     Document Type: Article

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