Information card for entry 4326174

Structure parameters

• Formula: H18 O17 S2 Th
• Calculated formula: H18 O17 S2 Th
• SMILES: [Th]([OH2])([OH2])([OH2])([OH2])([OH2])([OH2])([OH2])(OS(=O)(=O)[O-])OS(=O)(=O)[O-].O.O
• 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: 7.2244 ± 0.0009 Å
• b: 12.1506 ± 0.0014 Å
• c: 7.9889 ± 0.0009 Å
• α: 90°
• β: 98.289 ± 0.002°
• γ: 90°
• Cell volume: 693.95 ± 0.14 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 11
• Hermann-Mauguin space group symbol: P 1 21/m 1
• Hall space group symbol: -P 2yb
• Residual factor for all reflections: 0.0413
• Residual factor for significantly intense reflections: 0.0305
• Weighted residual factors for significantly intense reflections: 0.059
• Weighted residual factors for all reflections included in the refinement: 0.062
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No