Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
7673275 | Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy | 2014 | 51 Pages |
Abstract
- The assignments made with only reasonable deviations from the experimental values.
- The NBO result reflects the charge transfer due to bonding to anti-bonding orbitals.
- Theoretical UV-Vis spectral analysis was predicted mainly due to Ï â Ïâ type.
- The MEP map was also analysed.
Related Topics
Physical Sciences and Engineering
Chemistry
Analytical Chemistry
Authors
P. Muniappan, R. Meenakshi, G. Rajavel, M. Arivazhagan,