Charge transfer and blue shifting of vibrational frequencies in a hydrogen bond acceptor

Journal of Physical Chemistry A

Volumn 117, Issue 26, 2013, Pages 5435-5446

  Wright, Ashley M ^a   Howard, Austin A ^a   Howard, J Coleman ^a   Tschumper, Gregory S ^a   Hammer, Nathan I ^a  

^a UNIVERSITY OF MISSISSIPPI   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

HYDROGEN BOND ACCEPTORS; HYDROGEN BOND DONORS; NATURAL BOND ORBITAL; RAMAN SPECTROSCOPIC; SPECTRAL COMPONENTS; STRETCHING FREQUENCY; STRUCTURE COMPUTATION; VIBRATIONAL ENERGIES;

AROMATIC COMPOUNDS; BINARY MIXTURES; CHARGE TRANSFER; DRUG PRODUCTS; ELECTRONIC STRUCTURE; ETHYLENE GLYCOL;

HYDROGEN BONDS;

ACETIC ACID; ACETONITRILE; ACETONITRILE DERIVATIVE; AMINE; HEXYLAMINE; METHANOL; PYRIMIDINE; PYRIMIDINE DERIVATIVE; SOLVENT; THIOGLYCOLIC ACID DERIVATIVE;

CHEMISTRY; HYDROGEN BOND; QUANTUM THEORY; RAMAN SPECTROMETRY; VIBRATION;

ACETIC ACID; ACETONITRILES; AMINES; HYDROGEN BONDING; METHANOL; PYRIMIDINES; QUANTUM THEORY; SOLVENTS; SPECTRUM ANALYSIS, RAMAN; THIOGLYCOLATES; VIBRATION;

EID: 84879752100     PISSN: 10895639     EISSN: 15205215     Source Type: Journal    
DOI: 10.1021/jp401642b     Document Type: Article

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