Hydrogen-bond acidity of OH groups in various molecular environments (phenols, alcohols, steroid derivatives, and amino acids structures): Experimental measurements and density functional theory calculations

Journal of Physical Chemistry A

Volumn 117, Issue 49, 2013, Pages 13184-13193

  Graton, Jéroîme ^a   Besseau, François ^a   Brossard, Anne Marie ^a   Charpentier, Eloïse ^a   Deroche, Arnaud ^a   Le Questel, Jean Yves ^a  

^a UNIVERSITÉ DE NANTES   (France)

Author keywords

[No Author keywords available]

Indexed keywords

ANTIBONDING ORBITAL; BOND CRITICAL POINTS; FTIR SPECTROMETRY; HYDROXYL GROUPS; HYDROXYL MOIETY; MOLECULAR ENVIRONMENT; N-METHYL PYRROLIDINONE; POOR SOLUBILITIES;

AMINO ACIDS; CHLORINE COMPOUNDS; DENSITY FUNCTIONAL THEORY; EQUILIBRIUM CONSTANTS;

HYDROGEN;

ALCOHOL DERIVATIVE; AMINO ACID; HYDROXIDE; HYDROXIDE ION; PHENOL; STEROID;

ARTICLE; CHEMICAL STRUCTURE; CHEMISTRY; HYDROGEN BOND; QUANTUM THEORY;

ALCOHOLS; AMINO ACIDS; HYDROGEN BONDING; HYDROXIDES; MOLECULAR STRUCTURE; PHENOL; QUANTUM THEORY; STEROIDS;

EID: 84890520707     PISSN: 10895639     EISSN: 15205215     Source Type: Journal    
DOI: 10.1021/jp410027h     Document Type: Article

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