Information card for entry 4312330

Structure parameters

• Chemical name: nickel hydroxysulfate
• Formula: H6 Ni3 O12 S2
• Calculated formula: H6 Ni3 O12 S2
• SMILES: [Ni][OH2].[Ni][OH2].[Ni+2].[OH-].[OH-].S(=O)(=O)([O-])[O-].S(=O)(=O)([O-])[O-]
• Title of publication: Hydrothermal Synthesis in the System Ni(OH)2-NiSO4: Nuclear and Magnetic Structures and Magnetic Properties of Ni3(OH)2(SO4)2(H2O)2
• Authors of publication: Serge Vilminot; Mireille Richard-Plouet; Gilles André; Dariusz Swierczynski; Françoise Bourée-Vigneron; Mohamedally Kurmoo
• Journal of publication: Inorganic Chemistry
• Year of publication: 2003
• Journal volume: 42
• Pages of publication: 6859 - 6867
• a: 7.1485 ± 0.0003 Å
• b: 9.6844 ± 0.0004 Å
• c: 12.6643 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 876.74 ± 0.06 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 57
• Hermann-Mauguin space group symbol: P b c m
• Hall space group symbol: -P 2c 2b
• Residual factor for all reflections: 0.0335
• Residual factor for significantly intense reflections: 0.0319
• Weighted residual factors for all reflections: 0.0847
• Weighted residual factors for significantly intense reflections: 0.0835
• Goodness-of-fit parameter for all reflections: 1.12
• Goodness-of-fit parameter for significantly intense reflections: 1.137
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No