Medium effect on the equilibrium geometries, vibrational frequencies and solvation energies of sulfanilamide

Journal of Molecular Structure: THEOCHEM

Volumn 960, Issue 1-3, 2010, Pages 63-72

  Halim, Mohammad A ^a   Shaw, Dawn M ^a   Poirier, Raymond A ^a  

^a MEMORIAL UNIVERSITY OF NEWFOUNDLAND   (Canada)

Author keywords

Polarizable continuum model; Solvation free energy; Solvent effect; Sulfanilamide; Vibrational frequency

Indexed keywords

EID: 84962436628     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.theochem.2010.08.027     Document Type: Article

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