MO-calculations on the solvation effects on the structure of natural flavonoids in aqueous and acetone phases

Journal of Molecular Structure: THEOCHEM

Volumn 715, Issue 1-3, 2005, Pages 227-239

  Codorniu Hernández, Edelsys ^a   Mesa Ibirico, Ariel ^a   Montero Cabrera, Luis ^b   Martinez Luzardo, Francisco ^a   Stohrer, Wolf Dieter ^c  

^a Higher Institute of Technologies and Applied Sciences   (Cuba)

^b UNIVERSITY OF HAVANA   (Cuba)

^c UNIVERSITY OF BREMEN   (Germany)

Author keywords

Dimer; Flavonoid; Monomer; Quantum chemistry; Solvent effect; Tannin

Indexed keywords

ACETONE; DIMER; FLAVONOID; MONOMER;

ARTICLE; CALCULATION; CHEMICAL ANALYSIS; CHEMICAL STRUCTURE; CONFORMATION; DIMERIZATION; QUANTUM CHEMISTRY; SOLVATION; STRUCTURE ANALYSIS; THERMODYNAMICS;

EID: 13944254110     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.theochem.2004.09.059     Document Type: Article

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