Synthesis, Characterization and Theoretical Studies of new Azo compound derived from Coumarin | ||
| Al-Mustansiriyah Journal of Science | ||
| Article 1, Volume 25, Issue 1, March 2014, Pages 61-68 | ||
| Author | ||
| Redha I. Al-Bayat | ||
| Abstract | ||
| New coumarin derivatives, namely, N'-(3-bromobenzylidene)-4-((7-hydroxy-4-methyl-2-oxo-2H-chromen-8-yl)diazenyl)benzohydrazide was synthesized and characterized by means of it UV-VIS, FT-IR and 1HNMR spectral data. Density Functional Theory (DFT) calculations for the synthesized compound was performed using molecular structure with optimized geometry. Molecular orbital calculations have provided detailed descriptions of the orbitals, including spatial characteristics, modal patterns, and the contributions of individual atoms. | ||
|
Statistics Article View: 113 PDF Download: 75 |
||