Information card for entry 4327660

Structure parameters

• Formula: Cs2 Ni4 O48 P W9
• Calculated formula: Cs2 Ni4 O48 P W9
• Title of publication: A Cubane-Substituted Polyoxoanion: Structure and Magnetic Properties of Cs2[H2PW9Ni4O34(OH)3(H2O)6].5H2O
• Authors of publication: Ulrich Kortz; André Tézé; Gilbert Hervé
• Journal of publication: Inorganic Chemistry
• Year of publication: 1999
• Journal volume: 38
• Pages of publication: 2038 - 2042
• a: 24.3131 ± 0.0003 Å
• b: 21.54 ± 0.0001 Å
• c: 19.8936 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 10418.4 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.1319
• Residual factor for significantly intense reflections: 0.0804
• Weighted residual factors for all reflections: 0.2108
• Weighted residual factors for significantly intense reflections: 0.1699
• Goodness-of-fit parameter for all reflections: 1.132
• Goodness-of-fit parameter for significantly intense reflections: 1.133
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No