Information card for entry 2004636

Structure parameters

• Chemical name: Tetrakis(dimethylsulphoxide-κ-O)copper(II) bis(perchlorate)
• Formula: C8 H24 Cl2 Cu O12 S4
• Calculated formula: C8 H24 Cl2 Cu O12 S4
• SMILES: [Cu]([O]=S(C)C)([O]=S(C)C)([O]=S(C)C)[O]=S(C)C.Cl(=O)(=O)(=O)[O-].Cl(=O)(=O)(=O)[O-]
• Title of publication: Tetrakis(dimethyl sulfoxide-<i>O</i>)copper(II) Bis(perchlorate)
• Authors of publication: Blake, A. J.; Grimditch, R. S.; Parsons, S.; Schröder, M.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1996
• Journal volume: 52
• Journal issue: 3
• Pages of publication: 514 - 516
• a: 14.28 ± 0.003 Å
• b: 10.426 ± 0.002 Å
• c: 16.112 ± 0.004 Å
• α: 90°
• β: 112.065 ± 0.014°
• γ: 90°
• Cell volume: 2223.1 ± 0.9 ų
• Cell temperature: 240 ± 0.2 K
• Ambient diffraction temperature: 240 ± 0.2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/a 1
• Hall space group symbol: -P 2yab
• Residual factor for all reflections: 0.1548
• Residual factor for significantly intense reflections: 0.0649
• Weighted residual factors for all reflections: 0.1349
• Weighted residual factors for significantly intense reflections: 0.106
• Goodness-of-fit parameter for all reflections: 0.977
• Goodness-of-fit parameter for significantly intense reflections: 1.119
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No