Information card for entry 4338666

Structure parameters

• Common name: Hafnium sulfate tetrahydrate
• Formula: H8 Hf O12 S2
• Calculated formula: H8 Hf O12 S2
• SMILES: [Hf]([OH2])([OH2])([OH2])[OH2].S(=O)(=O)([O-])[O-].S(=O)(=O)([O-])[O-]
• Title of publication: Changing Hafnium Speciation in Aqueous Sulfate Solutions: A High-Energy X-ray Scattering Study.
• Authors of publication: Kalaji, Ali; Skanthakumar, S.; Kanatzidis, Mercouri G.; Mitchell, John F.; Soderholm, L.
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 12
• Pages of publication: 6321 - 6328
• a: 5.4884 ± 0.0001 Å
• b: 11.6086 ± 0.0003 Å
• c: 25.871 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1648.31 ± 0.07 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 70
• Hermann-Mauguin space group symbol: F d d d
• Hall space group symbol: -F 2uv 2vw
• Residual factor for all reflections: 0.011
• Residual factor for significantly intense reflections: 0.0108
• Weighted residual factors for significantly intense reflections: 0.0259
• Weighted residual factors for all reflections included in the refinement: 0.0259
• Goodness-of-fit parameter for all reflections included in the refinement: 1.328
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No