σ- and π-electron contributions to the substituent effect: Natural population analysis

Journal of Physical Organic Chemistry

Volumn 22, Issue 8, 2009, Pages 769-778

  Ozimiński, Wojclech P ^a   Dobrowolski, Jan C ^a,b  

^a NATIONAL MEDICINES INSTITUTE   (Poland)

^b INDUSTRIAL CHEMISTRY RESEARCH INSTITUTE   (Poland)

Author keywords

; DFT; Electron acceptor; Electron donor; NBO; Substituent effect

Indexed keywords

DFT; ELECTRON ACCEPTOR; ELECTRON DONOR; NBO; SUBSTITUENT EFFECT;

BENZENE; ETHYLENE; METHANE; PROBABILITY DENSITY FUNCTION;

ELECTRONS;

EID: 67650848178     PISSN: 08943230     EISSN: 10991395     Source Type: Journal    
DOI: 10.1002/poc.1530     Document Type: Article

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