Theoretical study of 1,3,4,6,7,9,9b-heptaazaphenalene and its ten derivatives

Journal of Physical Chemistry A

Volumn 108, Issue 1, 2004, Pages 97-106

  Zheng, Wenxu ^a   Wong, Ning Bew ^b   Wang, Weizhou ^a   Zhou, Ge ^a   Tian, Anmin ^a  

^a SICHUAN UNIVERSITY   (China)

^b CITY UNIVERSITY OF HONG KONG   (Hong Kong)

Author keywords

[No Author keywords available]

Indexed keywords

ATOMS; CHEMICAL BONDS; COMPUTER SIMULATION; DERIVATIVES; ELECTRONIC STRUCTURE; MOLECULAR ORIENTATION; MOLECULAR VIBRATIONS; PROBABILITY DENSITY FUNCTION; X RAY CRYSTALLOGRAPHY;

HARMONIC VIBRATIONAL FREQUECIES; HEPTAAZAPHENALENE; HIGH ENERGY DENSITY MATERIAL PROPERTIES;

AROMATIC COMPOUNDS;

EID: 1542356440     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp035558i     Document Type: Article

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