Information card for entry 4000301

Structure parameters

• Formula: H5 O9 P2 Sc
• Calculated formula: H5 O9 P2 Sc
• Title of publication: Hydrothermal synthesis and structural characterization of four scandium phosphate frameworks
• Authors of publication: Bull, I.; Young, V.; Teat, S. J.; Peng, L.; Grey, C. P.; Parise, J. B.
• Journal of publication: Chemistry of Materials
• Year of publication: 2003
• Journal volume: 15
• Pages of publication: 3818 - 3825
• a: 5.3048 ± 0.0011 Å
• b: 8.823 ± 0.0018 Å
• c: 14.779 ± 0.003 Å
• α: 90°
• β: 95.685 ± 0.005°
• γ: 90°
• Cell volume: 688.3 ± 0.2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0584
• Residual factor for significantly intense reflections: 0.0433
• Weighted residual factors for significantly intense reflections: 0.0927
• Weighted residual factors for all reflections included in the refinement: 0.0963
• Goodness-of-fit parameter for all reflections included in the refinement: 0.977
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No