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Synthesis and studies of rare acylhydrazine bridged strong antiferromagnetically coupled dicopper(II) and dioxovanadium(V) complexes of a pyridyl-pyrazole derived Schiff base ligand
Jana, Atanu2; Konar, Saugata2; Mandal, Tarak Nath3; Das, Kinsuk4; Ray, Sangita2; Sarkar, Ananda5; Liu, Cai-Ming1; Kar, Susanta Kumar2
刊名POLYHEDRON
2012-10-09
卷号46期号:1页码:105-112
关键词Coordination Acylhydrazine Binuclear Copper Complex Binuclear Oxovanadium Complex Crystal Magnetism Dft
ISSN号0277-5387
DOI10.1016/j.poly.2012.07.076
英文摘要A binuclear acylhydrazine bridged Cu(II) complex, [Cu-2(L)(NO3)(3)(H2O)] (1), and an anti-orthogonal binuclear oxovanadium(V) complex, [V2O4(L)(2)] (2), have been synthesized and characterized spectroscopically and crystallographically. The ligand HL has two potentially bridging functional groups (mu-O, mu-N-N) and consequently can exist in the following coordination conformers: (a) metal centers bridged by mu-O, (b) metal centers bridged by mu-N-N. A rare acylhydrazine bridged (a) type configuration exists in the dinuclear Cu(II) complex 1. The bridging ligand mediates a strong antiferromagnetic coupling (J = -99 cm(-1)). The exchange pathway parameters have also been evaluated from density functional theoretical calculations to corroborate the bridging signatures with experimental findings (J = -93.96 cm(-1)). Molecule 2 has a centrosymmetric structure with each vanadium center having a distorted octahedral geometry. It shows a one step irreversible reduction at +0.43 V. The bond angles, bond lengths and torsion angles in 2 are correlated with DFT. (C) 2012 Elsevier Ltd. All rights reserved.
语种英语
出版者PERGAMON-ELSEVIER SCIENCE LTD
WOS记录号WOS:000311023900014
内容类型期刊论文
源URL[http://ir.iccas.ac.cn/handle/121111/47911]  
专题中国科学院化学研究所
通讯作者Liu, Cai-Ming
作者单位1.Chinese Acad Sci, Inst Chem, Ctr Mol Sci, Beijing Natl Lab Mol Sci, Beijing 100190, Peoples R China
2.Univ Calcutta, Univ Coll Sci, Dept Chem, Kolkata 700009, India
3.Korea Res Inst Chem Technol, Taejon 305606, South Korea
4.Haldia Govt Coll, Dept Chem, Debhog 721657, Purba Midnapur, India
5.APC Coll, Kolkata 700131, India
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Jana, Atanu,Konar, Saugata,Mandal, Tarak Nath,et al. Synthesis and studies of rare acylhydrazine bridged strong antiferromagnetically coupled dicopper(II) and dioxovanadium(V) complexes of a pyridyl-pyrazole derived Schiff base ligand[J]. POLYHEDRON,2012,46(1):105-112.
APA Jana, Atanu.,Konar, Saugata.,Mandal, Tarak Nath.,Das, Kinsuk.,Ray, Sangita.,...&Kar, Susanta Kumar.(2012).Synthesis and studies of rare acylhydrazine bridged strong antiferromagnetically coupled dicopper(II) and dioxovanadium(V) complexes of a pyridyl-pyrazole derived Schiff base ligand.POLYHEDRON,46(1),105-112.
MLA Jana, Atanu,et al."Synthesis and studies of rare acylhydrazine bridged strong antiferromagnetically coupled dicopper(II) and dioxovanadium(V) complexes of a pyridyl-pyrazole derived Schiff base ligand".POLYHEDRON 46.1(2012):105-112.
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