1. Synthesis, spectral, DFT calculations and biological activity studies of vanadyl complexes with L-aspartic acid and imidazoles/1,10-phenanthroline as co-ligands
- Author
-
Patel, R. N., Maurya, K., Singh, Y. P., Singh, Y., Rather, S., Kamal, A., and Prof. Indra Prasad Tripathi
- Subjects
TD-DFT calculations ,Vanadium(IV) complexes ,antidiabetic properties ,ESR (electron spin resonance) ,DFT - Abstract
Department of Chemistry, A. P. S. University, Rewa-486 003, Madhya Pradesh, India E-mail : rnp64@ymail.com Department of Chemistry, MGCGV, Chitrakoot, Satna-485 334, Madhya Pradesh, India Manuscript received online 14 December 2016, accepted 15 December 2016 Five vanadium(IV) complexes [VO(Aspa)(L)], where Aspa = L-aspartic acid, L = imidazole, 2-methylimidazole, 2-ethylimidazole, 2-methylbenzimidazole and 1,10-phenanthroline, have been synthesized and characterized by microanalysis, FTIR, UV-Visible, ESR spectroscopy and cyclic voltammetry. The geometrical parameters of these complexes were performed by DFT and TD-DFT methods. The theoretical calculations confirm that the vanadium(IV) center exhibited square pyramidal geometry in 1-4 and distorted octahedral geometry in 5. The paramagnetic resonance g-factor and the magnetic susceptibilities (magnetic moments) of vanadyl complexes are discussed. The complexes were also tested for their in vitro antidiabetic activity (α-glucosidase inhibition activity). The complexes exhibited moderate antidiabetic properties.
- Published
- 2017
- Full Text
- View/download PDF