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Synthesis, molecular structure, hydrogen-bonding and chemical reactivity analysis of 1,9-bis(2-cyano-2-ethoxycarbonylvinyl)-5-(2-chlorophenyl)-dipyrromethane: A combined experimental and theoretical approach.

Authors :
Tiwari, R.K.
Kumar, Amit
Rawat, Poonam
Singh, R.N.
Source :
Journal of Molecular Structure. Sep2013, Vol. 1047, p169-178. 10p.
Publication Year :
2013

Abstract

Highlights: [•] FT-IR spectrum of the studied compound has been compared with the theoretical results. [•] The resonance assisted intramolecular hydrogen bonds has been characterized using AIM calculations.. [•] The electronic transitions for the synthesized compound have been predicted. [•] The 1H NMR spectrum for title compound has been studied.. [•] Chemical reactivity has been explained with the aid of electronic descriptors. [Copyright &y& Elsevier]

Details

Language :
English
ISSN :
00222860
Volume :
1047
Database :
Academic Search Index
Journal :
Journal of Molecular Structure
Publication Type :
Academic Journal
Accession number :
89311478
Full Text :
https://doi.org/10.1016/j.molstruc.2013.04.056