Information card for entry 4325265

Structure parameters

• Formula: C5 H10 N O7 P V
• Calculated formula: C5 H10 N O7 P V
• Title of publication: A Vanadium (VO2+) Metal-Organic Framework: Selective Vapor Adsorption, Magnetic Properties, and Use as a Precursor for a Polyoxovanadate
• Authors of publication: Prakash Kanoo; Ashta Chandra Ghosh; Tapas Kumar Maji
• Journal of publication: Inorganic Chemistry
• Year of publication: 2011
• Journal volume: 50
• Pages of publication: 5145 - 5152
• a: 6.3846 ± 0.0005 Å
• b: 16.7722 ± 0.0019 Å
• c: 8.9996 ± 0.0012 Å
• α: 90°
• β: 100.121 ± 0.008°
• γ: 90°
• Cell volume: 948.71 ± 0.18 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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: 0.1424
• Residual factor for significantly intense reflections: 0.075
• Weighted residual factors for significantly intense reflections: 0.1763
• Weighted residual factors for all reflections included in the refinement: 0.208
• Goodness-of-fit parameter for all reflections included in the refinement: 1.07
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No