Vibrational spectroscopy of protonated imidazole and its complexes with water molecules: Ab initio anharmonic calculations and experiments

Journal of Physical Chemistry A

Volumn 111, Issue 31, 2007, Pages 7374-7381

  Adesokan, Adeyemi A ^a   Chaban, Galina M ^b   Dopfer, Otto ^c   Gerber, R Benny ^a,b,d  

^a UNIVERSITY OF CALIFORNIA   (United States)

^b NASA AMES RESEARCH CENTER   (United States)

^c TECHNISCHE UNIVERSITÄT BERLIN   (Germany)

^d HEBREW UNIVERSITY OF JERUSALEM   (Israel)

Author keywords

[No Author keywords available]

Indexed keywords

INFRARED SPECTROSCOPY; NATURAL FREQUENCIES; PHOTODISSOCIATION; POTENTIAL ENERGY; PROTONATION; VIBRATIONAL SPECTROSCOPY;

AB INITIO ANHARMONIC CALCULATIONS; ANHARMONIC FREQUENCIES; PROTONATED IMIDAZOLE; WATER MOLECULES;

NITROGEN COMPOUNDS;

IMIDAZOLE DERIVATIVE; PROTON; WATER;

ALGORITHM; ARTICLE; CHEMISTRY; ENERGY TRANSFER; MACROMOLECULE; SPECTROSCOPY; THERMODYNAMICS; VIBRATION;

ALGORITHMS; ENERGY TRANSFER; IMIDAZOLES; MACROMOLECULAR SUBSTANCES; PROTONS; SPECTRUM ANALYSIS; THERMODYNAMICS; VIBRATION; WATER;

EID: 34548026553     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp070785w     Document Type: Article

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