Information card for entry 4326173

Structure parameters

• Formula: H2 O6 S Th
• Calculated formula: H2 O6 S Th
• SMILES: [Th+4].S(=O)(=O)([O-])[O-].[OH-].[OH-]
• Title of publication: Synthesis and Characterization of Thorium(IV) Sulfates
• Authors of publication: Karah E. Knope; Richard E. Wilson; S. Skanthakumar; L. Soderholm
• Journal of publication: Inorganic Chemistry
• Year of publication: 2011
• Journal volume: 50
• Pages of publication: 8621 - 8629
• a: 11.6838 ± 0.001 Å
• b: 6.047 ± 0.0005 Å
• c: 7.0471 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 497.89 ± 0.07 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 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 all reflections: 0.0204
• Residual factor for significantly intense reflections: 0.0192
• Weighted residual factors for significantly intense reflections: 0.0454
• Weighted residual factors for all reflections included in the refinement: 0.0458
• Goodness-of-fit parameter for all reflections included in the refinement: 1.197
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No