کد مقاله | کد نشریه | سال انتشار | مقاله انگلیسی | نسخه تمام متن |
---|---|---|---|---|
1334602 | 1500285 | 2013 | 9 صفحه PDF | دانلود رایگان |
عنوان انگلیسی مقاله ISI
Dinuclear oxidovanadium(V) complexes incorporating N, N, O, O coordinating ligands: Synthesis, structure, spectral, DFT and TDDFT study
دانلود مقاله + سفارش ترجمه
دانلود مقاله ISI انگلیسی
رایگان برای ایرانیان
موضوعات مرتبط
مهندسی و علوم پایه
شیمی
شیمی معدنی
پیش نمایش صفحه اول مقاله
چکیده انگلیسی
Three new dinuclear oxidovanadium(V) complexes have been synthesized using N, N, O, O coordinating ligands. The complexes are isolated and characterized by different spectroscopic techniques. X-ray structure of a representative complex has been determined. The electronic structure, absorption and CD spectra of the complexes were calculated applying DFT-TDDFT method. The chemical shift was also computed using GIAO-DFT calculation. The occupancies and composition of the natural bond orbitals (NBOs) for all the complexes were also calculated using DFT.
ناشر
Database: Elsevier - ScienceDirect (ساینس دایرکت)
Journal: Polyhedron - Volume 54, 30 April 2013, Pages 228-236
Journal: Polyhedron - Volume 54, 30 April 2013, Pages 228-236
نویسندگان
Pallab Mondal, Amar Hens, Kajal Krishna Rajak,