Information card for entry 4030180

Structure parameters

• Formula: H2 O6 S Zr
• Calculated formula: O6 S Zr
• SMILES: [Zr+4].S(=O)(=O)([O-])[O-].[OH-].[OH-]
• Title of publication: Structure cristalline du sulfate basique de zirconium Zr(OH)2SO4
• Authors of publication: El Brahimi, M.; Durand, J.; Cot, L.
• Journal of publication: European Journal of Solid State and Inorganic Chemistry
• Year of publication: 1988
• Journal volume: 25
• Pages of publication: 185 - 189
• a: 11.09 ± 0.02 Å
• b: 5.543 ± 0.001 Å
• c: 6.656 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 409.2 ± 0.8 ų
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 4
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for significantly intense reflections: 0.024
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No