Influence of rotational isomerism on tautomerism and basicity of histamine and its model 4(5)-alkylimidazoles — AM1 studies for isolated molecules
Author:
Publisher
Elsevier BV
Subject
Physical and Theoretical Chemistry,Condensed Matter Physics,Biochemistry
Reference34 articles.
1. Ionization of histamine, N-acetylhistamine, and their iodinated derivatives
2. A theoretical investigation of histamine tautomerism
3. The intrinsic basicity of 4(5)-2'-aminoethylimidazole (histamine)
4. Superbases in the gas phase. Part II. Further extension of the basicity scale using acyclic and cyclic guanidines
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3. Spectroscopic (FTIR, FT-Raman, 13C and 1H NMR) investigation, molecular electrostatic potential, polarizability and first-order hyperpolarizability, FMO and NBO analysis of 1-methyl-2-imidazolethiol;Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy;2014-01
4. A comparative study on vibrational, conformational and electronic structure of 1,2-dimethyl-5-nitroimidazole and 2-methyl-5-nitroimidazole;Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy;2012-11
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