Information card for entry 4301274

Structure parameters

• Formula: C6 H11 O11.5 P2 V2
• Calculated formula: C6 H4 O11.5 P2 V2
• Title of publication: The Hydrothermal and Structural Chemistry of Oxovanadium-Arylphosphonate Networks and Frameworks
• Authors of publication: Wayne Ouellette; Guangbin Wang; Hongxue Liu; Gordon T. Yee; Charles J. O'Connor; Jon Zubieta
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Pages of publication: 953 - 963
• a: 7.1733 ± 0.0005 Å
• b: 9.8385 ± 0.0006 Å
• c: 18.2882 ± 0.0012 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1290.68 ± 0.15 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0405
• Residual factor for significantly intense reflections: 0.0354
• Weighted residual factors for significantly intense reflections: 0.0901
• Weighted residual factors for all reflections included in the refinement: 0.0932
• Goodness-of-fit parameter for all reflections included in the refinement: 1.079
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No