Author/Authors :
Dodds. Christopher A. Westchem - Department of Pure & Applied Chemistry- University of Strathclyde, Scotland , Kennedy, Alan R. Westchem - Department of Pure & Applied Chemistry- University of Strathclyde, Scotland
Abstract :
The complete nonanuclear cluster in bis[1,3-bis(2,6-dimethylphenyl)imidazolium] di-μ-chlorido-tetrachloridooctakis(μ-3,5-dimethylpyrazolato)hexa-μ3-hydroxido-nonacopper(II) chloroform disolvate, [HIXy]2[Cu9(μ-pz*)8(μ3-OH)6(μ2-Cl)2Cl4]·2CHCl3 or (C19H21N2)2[Cu9(C5H7N2)8Cl6(OH)6]·2CHCl3, where pz* is the 3,5-dimethylpyrazolyl anion, C5H7N2−, and HIXy is the 1,3-bis(2,6-dimethylphenyl)imidazolium cation, C19H21N2+, is generated by a crystallographic centre of symmetry with a square-planar CuII ion bound to four μ3-OH ions lying on the inversion centre. Of the four remaining unique CuII atoms, three adopt CuN2O2Cl square-pyramidal coordination geometries with the chloride ion in the apical position and one has a distorted CuN2OCl tetrahedral geometry. The dianionic nonanuclear core can be described as a 24-membered [CuNN]8 ring that contains a Cu9O6Cl6 core. The cluster features three intramolecular O—H⋯Cl hydrogen bonds. In the crystal, weak C—H⋯N and C—H⋯Cl interactions link the components. Polynuclear paramagnetic clusters of this type are of considerable interest due to their relevance to both the bioinorganic and single-molecule magnets research fields.
Keywords :
crystal structure , copper , N-heterocyclic carbene , cluster