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Novel rhenium oxocomplexes of 2-hydroxymethylbenzimidazole – Synthesis, X-ray studies, spectroscopic characterization and DFT calculations by B. Machura; M. Wolff; J. Kusz is a Chemistry article available to read on EtoBox.
What is Novel rhenium oxocomplexes of 2-hydroxymethylbenzimidazole – Synthesis, X-ray studies, spectroscopic characterization and DFT calculations about?
Three novel rhenium oxocomplexes of biologically relevant ligand 2-hydroxymethylbenzimidazole: cis-[ReOCl 2 (hmbzim)(PPh 3 )] (1), cis-[ReOBr 2 (hmbzim)(PPh 3 )] and [ReO(hmbzim) 2 (PPh 3 )](ReO 4 )ÁCH 3 OH (3) have been synthesized and characterized spectroscopically and structurally (by single-crystal X-ray diffraction). The electronic spectra of 1 and 3 were investigated at the TDDFT level employing B3LYP functional in combination with LANL2DZ. Additional information about binding in the complexes 1 and 3 was obtained by NBO analysis.
Who reads Novel rhenium oxocomplexes of 2-hydroxymethylbenzimidazole – Synthesis, X-ray studies, spectroscopic characterization and DFT calculations?
It is typically read by researchers, students, and practitioners in Chemistry.
- Author
- B. Machura; M. Wolff; J. Kusz
- Publisher
- Elsevier Science; Elsevier ; Elsevier Ltd.; Elsevier BV (ISSN 0277-5387)
- Published
- 2010
- Language
- EN
- Field
- Chemistry (Physical Sciences)