The electrostatic potential at atomic sites as a reactivity index in the hydrogen bond formation

Journal of Molecular Structure: THEOCHEM

Volumn 630, Issue 1-3, 2003, Pages 101-112

  Galabov, B ^a   Bobadova Parvanova, P ^a   Ilieva, S ^a   Dimitrova, V ^a  

^a UNIVERSITY OF SOFIA   (Bulgaria)

Author keywords

Acetylene derivatives; Carbonyl derivatives; Hydrogen bond descriptor; Hydrogen bonding; Molecular electrostatic potential; Nitrile derivatives

Indexed keywords

ACETYLENE DERIVATIVE; ALDEHYDE; AMMONIA; CARBONYL DERIVATIVE; CYANIDE; HYDROFLUORIC ACID; HYDROGEN; NITRILE; NITROGEN; OXYGEN;

ACIDITY; ATOM; COMPLEX FORMATION; CONFERENCE PAPER; CORRELATION ANALYSIS; CORRELATION COEFFICIENT; DECOMPOSITION; DENSITY; ELECTRICITY; ELECTRON TRANSPORT; ENERGY; HYDROGEN BOND; LINEAR REGRESSION ANALYSIS; MATHEMATICAL ANALYSIS; NUCLEAR PHYSICS; PREDICTION; QUANTITATIVE ANALYSIS; THEORY;

EID: 0037493102     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0166-1280(03)00149-0     Document Type: Conference Paper

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