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Seven-coordinate rhenium(III) complexes of 1-(2-pyridylazo)-2-naphtholate: X-ray studies,spectroscopic characterization and DFT calculations
Authors:B Machura  J Mroziński  R Kruszynski  J Kusz
Institution:1. Department of Crystallography, Institute of Chemistry, University of Silesia, 9th Szkolna Street, 40-006 Katowice, Poland;2. Faculty of Chemistry, Wroclaw University, F. Joliot-Curie 14 Street, 50-383 Wroc?aw, Poland;3. Department of X-ray Crystallography and Crystal Chemistry, Institute of General and Ecological Chemistry, Lodz University of Technology, 116 ?eromski Street, 90-924 Lodz, Poland;4. Institute of Physics, University of Silesia, 4th Uniwersytecka Street, 40-006 Katowice, Poland
Abstract:The reactions of ReX3(MeCN)(PPh3)2] (X = Cl or Br) with 1-(2-pyridylazo)-2-naphthol (HPAN) have been examined and the ReBr(PAN)2] · 2CHCl3 (1) and ReCl(PAN)2] (2) complexes have been obtained. The both complexes have been structurally and spectroscopically characterized, and compound 1 has been additionally studied by magnetic measurements. The magnetic behavior is characteristic of mononuclear seven-coordinated Re(III) complex with d4 low-spin configuration, which gives diamagnetic ground state.
Keywords:Rhenium complexes  1-(2-Pyridylazo)-2-naphthol  X-ray and electronic structure  DFT calculations
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