Information card for entry 4116534

Structure parameters

• Formula: H94 N14 O91 P2 U2 W18
• Calculated formula: O105 P2 U2 W18
• Title of publication: Cation-Directed Structure Changes in Polyoxometalate Chemistry. Equilibria between Isomers of Bis(9-tungstophosphatodioxouranate(VI)) Complexes
• Authors of publication: Kee-Chan Kim; Michael T. Pope
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 1999
• Journal volume: 121
• Pages of publication: 8512 - 8517
• a: 12.601 ± 0.0017 Å
• b: 20.175 ± 0.003 Å
• c: 35.124 ± 0.008 Å
• α: 90°
• β: 99.056 ± 0.019°
• γ: 90°
• Cell volume: 8818 ± 3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0839
• Residual factor for significantly intense reflections: 0.0563
• Weighted residual factors for significantly intense reflections: 0.1346
• Weighted residual factors for all reflections included in the refinement: 0.1449
• Goodness-of-fit parameter for all reflections included in the refinement: 1.069
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No