A computational study of the effects of different solvents on the characteristics of the intramolecular hydrogen bond in acylphloroglucinols

Journal of Physical Chemistry A

Volumn 113, Issue 52, 2009, Pages 15064-15077

  Mammino, Liliana ^a   Kabanda, Mwadham M ^a  

^a UNIVERSITY OF VENDA   (South Africa)

Author keywords

[No Author keywords available]

Indexed keywords

BIOLOGICAL ACTIVITIES; COMPUTATIONAL STUDIES; CONFORMATIONAL PREFERENCES; DIFFERENT SOLVENTS; ENERGY INCREASE; GEOMETRY FACTORS; H-BOND STRENGTH; HF/6-31G; INTRAMOLECULAR HYDROGEN BOND; PCM MODEL; SIMILAR PATTERN; SOLUTE MOLECULES; SOLVENT STABILIZATION;

ACETONITRILE; BIOACTIVITY; HYDROGEN; MODEL STRUCTURES; PHENOLS; SOLVENTS;

HYDROGEN BONDS;

PHLOROGLUCINOL; SOLVENT;

ARTICLE; CHEMISTRY; HYDROGEN BOND; QUANTUM THEORY;

HYDROGEN BONDING; PHLOROGLUCINOL; QUANTUM THEORY; SOLVENTS;

EID: 73949121435     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp905180c     Document Type: Article

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