Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
1409591 | Journal of Molecular Structure | 2012 | 11 Pages |
Abstract
⺠The properties of nitroimidazoles are of interest due to their pharmaceutical importance. ⺠The structure, vibrational, electronic and NLO activity of 5-chloro-1-methyl-4-nitro-1H-imidazole (CMNI) was studied. ⺠The low frontier orbital energy gap explains the eventual charge transfer interaction taking place within the CMNI. ⺠CMNI exhibited good NLO activity.
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Related Topics
Physical Sciences and Engineering
Chemistry
Organic Chemistry
Authors
C. Sridevi, G. Velraj,