Theoretical Modelling for the Ground State Rotamerisation and Excited State Intramolecular Proton Transfer of 2-(2’-hydroxyphenyl)oxazole, 2-(2’-hydroxyphenyl)imidazole, 2-(2’-hydroxyphenyl)thiazole and Their Benzo Analogues

Theoretical Modelling for the Ground State Rotamerisation and Excited State Intramolecular Proton Transfer of 2-(2’-hydroxyphenyl)oxazole, 2-(2’-hydroxyphenyl)imidazole, 2-(2’-hydroxyphenyl)thiazole and Their Benzo Analogues

Abstract: Two series of compounds, one comprising of 2-(2′-hydroxyphenyl)benzoxazole (HBO), 2-(2′-hydroxyphenyl)benzimidazole (HBI), 2-(2′-hydroxyphenyl)benzothiazole (HBT), and the other of 2-(2′-hydroxyphenyl)oxazole (HPO), 2-(2′-hydroxyphenyl)imidazole (HPI) and 2-(2â€Â...

Full description

Bibliographic Details
Main Authors: Nitin Chattopadhyay, Pradipta Purkayastha
Format: Article
Language:English
Published: MDPI AG 2003-05-01
Series:International Journal of Molecular Sciences
Subjects:
Rotamerization
excited state intramolecular proton transfer
oxazole
imidazole
thiazole
tautomer
AM1
Online Access:http://www.mdpi.com/1422-0067/4/6/335/

Internet

http://www.mdpi.com/1422-0067/4/6/335/

Similar Items