Information card for entry 4341267

Structure parameters

• Formula: H49 Hf6 N7 O57.5 S10.5
• Calculated formula: Hf6 N7 O57.5 S10.5
• Title of publication: Aqueous hafnium sulfate chemistry: structures of crystalline precipitates.
• Authors of publication: Kalaji, Ali; Soderholm, L.
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 20
• Pages of publication: 11252 - 11260
• a: 19.0716 ± 0.0007 Å
• b: 9.9058 ± 0.0004 Å
• c: 14.1053 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2664.77 ± 0.17 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 59
• Hermann-Mauguin space group symbol: P m m n
• Hall space group symbol: -P 2ab 2a
• Residual factor for all reflections: 0.0254
• Residual factor for significantly intense reflections: 0.0223
• Weighted residual factors for significantly intense reflections: 0.0543
• Weighted residual factors for all reflections included in the refinement: 0.0557
• Goodness-of-fit parameter for all reflections included in the refinement: 1.113
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No