Quantum Chemical Studies on [Co(ntb)(pic)]+ Complex Ion

Authors : Koray SAYİN, Duran KARAKAS

Pages : 54-59

View : 17 | Download : 11

Publication Date : 2013-02-01

Article Type : Research Paper

Abstract :– Trisinsert ignore into journalissuearticles values(2-benzimidazolylmethyl);aminepicolinatocobalt insert ignore into journalissuearticles values(II);, [Coinsert ignore into journalissuearticles values(ntb);insert ignore into journalissuearticles values(pic);]+, complex were studied theoretically. [Coinsert ignore into journalissuearticles values(ntb);insert ignore into journalissuearticles values(pic);]+complex ion were synthesized and geometric parameters, vibration frequencies and UV-VIS spectrum were obtained by Nie et al. in 2010 [1]. In this study, optimized geometric parameters, vibrational spectrum, Molecular Orbital insert ignore into journalissuearticles values(MO); character analysis, Transition Character insert ignore into journalissuearticles values(TC); analysis and UV-VIS spectrum were calculated. The correlations between theoretical and experimental results were investigated
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