Density functional study of the interaction of 3-(ω-bromoacetyl) coumarin with phosphites

International Journal of Quantum Chemistry

Volumn 106, Issue 6, 2006, Pages 1357-1366

  Nathaniel, Rachel ^a   Mineva, Tzonka ^a   Nikolova, Rositca ^b   Bojilova, Anka ^b  

^a INSTITUTE OF CATALYSIS   (Bulgaria)

^b UNIVERSITY OF SOFIA   (Bulgaria)

Author keywords

Atomic fukui indices; DFT; Infrared frequencies; Phosphor containing coumarin derivatives; Total hardness

Indexed keywords

ALGORITHMS; FUNCTION EVALUATION; NITROGEN COMPOUNDS; PHOSPHATES;

ATOMIC FUKUI INDICES; INFRARED FREQUENCIES; PHOSPHOR-CONTAINING COUMARIN DERIVATIVES; TOTAL HARDNESS;

PROBABILITY DENSITY FUNCTION;

EID: 33645692546     PISSN: 00207608     EISSN: 1097461X     Source Type: Journal    
DOI: 10.1002/qua.20893     Document Type: Conference Paper

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