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Crystal and molecular structure of diaquobis(1,1′-dimethyl-2,2′-diimidazolylsulfide)copper(II) methylsulfate, (C8H10N4S)2Cu(II)(OH2)2(CH3OS03)2

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Abstract

The crystal and molecular structure of the title complex has been determined. The space group isP21/n, witha=8.460(3),b=8.503(3),c=20.341 (8) Å,β=98.41(3) andZ=2. The ligand molecules chelate the CuII such that the metal has a tetragonally distorted octahedral geometry; four N atoms occupy the equatorial plane and two H2O molecules occupy the axial positions. The average Cu-N and Cu-O distances are 2.005(6) and 2.47(1) Å, respectively. The novel ligand, 1,1′-dimethyl-2,2′-diimidazolylsulfide was formedin situ from a methanolic solution of copper(II) sulfate pentahydrate and 1-methylimidazole-2-thiol. The measured spectral parameters (visible, EPR, and photoelectron spectroscopy) correlate well with the molecular structure.

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Baldwin, D.A., Boeyens, J.C.A., Copperthwaite, R.G. et al. Crystal and molecular structure of diaquobis(1,1′-dimethyl-2,2′-diimidazolylsulfide)copper(II) methylsulfate, (C8H10N4S)2Cu(II)(OH2)2(CH3OS03)2 . Journal of Crystallographic and Spectroscopic Research 14, 157–167 (1984). https://doi.org/10.1007/BF01189557

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