Chemical bonding in zwitterionic diamino-meta-quinonoids and their isomers

Journal of Physical Organic Chemistry

Volumn 18, Issue 11, 2005, Pages 1123-1131

  Höltzl, Tibor ^a,b   Veszprémi, Tamás ^b   Nguyen, Minh Tho ^a  

^a UNIVERSITY OF LEUVEN   (Belgium)

^b BUDAPEST UNIVERSITY OF TECHNOLOGY AND ECONOMICS   (Hungary)

Author keywords

Ab initio calculations; Atoms in molecules analysis; Density functional theory; Diamino meta quinonoid structures; Substituent effects; Zwitterion structures

Indexed keywords

ELECTRONIC STRUCTURE; HYDROGEN; IONIZATION; ISOMERS; PROBABILITY DENSITY FUNCTION;

AB INITIO CALCULATIONS; ATOMS-IN-MOLECULES ANALYSIS; DIAMINO-META-QUINONOID MOLECULES; DIAMINO-META-QUINONOID STRUCTURES; SUBSTITUENT EFFECTS; ZWITTERION STRUCTURES;

CHEMICAL BONDS;

EID: 27144537746     PISSN: 08943230     EISSN: None     Source Type: Journal    
DOI: 10.1002/poc.978     Document Type: Article

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