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Volumn 111, Issue 51, 2007, Pages 13403-13414

8-Hydroxyquinoline monomer, water adducts, and dimer. Environmental influences on structure, spectroscopic properties, and relative stability of Cis and Trans conformers

Author keywords

[No Author keywords available]

Indexed keywords

CONFORMATIONS; DIMERS; MOLECULAR DYNAMICS; PROTON TRANSFER; QUANTUM YIELD; WATER;

EID: 38349152719     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp074510s     Document Type: Article
Times cited : (35)

References (54)
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    • In the case of ref 32, ab-initio computations gives a positive dimerization standard Gibbs energy of +1.82 kcal/mol for the most stable 7-hydroxyquinoline dimer, whereas the experimental standard Gibbs energy in benzene solution has been reported as -4.2 kcal/mol
    • In the case of ref 32, ab-initio computations gives a positive dimerization standard Gibbs energy of +1.82 kcal/mol for the most stable 7-hydroxyquinoline dimer, whereas the experimental standard Gibbs energy in benzene solution has been reported as -4.2 kcal/mol.


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