On simple, accurate calculations of atomic charges, bond properties and molecular energies. III. Oxygen-containing organic molecules

Journal of Molecular Structure: THEOCHEM

Volumn 668, Issue 2-3, 2004, Pages 217-224

  Fliszar S ^a   Chretien S ^a  

^a UNIVERSITÉ DE MONTRÉAL   (Canada)

Author keywords

Atomic charges; Bond energies; Nuclear magnetic resonance

Indexed keywords

ALCOHOL DERIVATIVE; ETHER DERIVATIVE; ORGANIC COMPOUND; OXYGEN;

ANALYTIC METHOD; ARTICLE; ATOM; CALCULATION; CARBON NUCLEAR MAGNETIC RESONANCE; CHEMICAL BOND; CORRELATION ANALYSIS; ENERGY; ENTHALPY; MOLECULAR DYNAMICS;

EID: 10744231922     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.theochem.2003.10.062     Document Type: Article

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