Characterization of intramolecular hydrogen bonds by atomic charges and charge fluxes

Journal of Physical Chemistry A

Volumn 116, Issue 32, 2012, Pages 8397-8406

  Baranović, Goran ^a   Biliškov, Nikola ^a   Vojta, Danijela ^a  

^a RUDER BO KOVI INSTITUTE   (Croatia)

Author keywords

[No Author keywords available]

Indexed keywords

ATOMIC CHARGE; C-H BOND; CHARGE FLUX; DONOR-ACCEPTORS; ELECTRONIC CHARGES; HYDROGEN ATOMS; INFRARED INTENSITY; INTERMOLECULAR HYDROGEN BONDS; INTRAMOLECULAR HYDROGEN BOND; INTRAMOLECULAR HYDROGEN BONDING; IR INTENSITIES; O-H BOND; O-HYDROXY; POLARIZABLE CONTINUUM MODEL; POLARIZABLE CONTINUUMS; SMALL MOLECULES; SPECTROSCOPIC CHARACTERISTICS;

ATOMS; CONTINUUM MECHANICS;

HYDROGEN BONDS;

EID: 84865137589     PISSN: 10895639     EISSN: 15205215     Source Type: Journal    
DOI: 10.1021/jp306070x     Document Type: Article

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