Information card for entry 8103038

Structure parameters

• Formula: B H2 Li3 O17 P4 V2
• Calculated formula: B H2 Li3 O17 P4 V2
• Title of publication: Crystal structure of trilithium divanadium(III) borophosphate hydrogenphosphate, Li3V2[BP3O12(OH)][HPO4]
• Authors of publication: Zhi-Sheng Lin; Stefan Hoffmann; Ya-Xi Huang; Yurii Prots; Jing-Tai Zhao; Rüdiger Kniep
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2010
• Journal volume: 225
• Journal issue: 1
• Pages of publication: 3
• a: 9.3783 ± 0.0005 Å
• b: 8.2313 ± 0.0004 Å
• c: 17.7504 ± 0.0009 Å
• α: 90°
• β: 119.394 ± 0.003°
• γ: 90°
• Cell volume: 1193.85 ± 0.11 ų
• Cell temperature: 295 K
• Ambient diffraction temperature: 295 K
• Number of distinct elements: 6
• 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: 0.0412
• Residual factor for significantly intense reflections: 0.0334
• Weighted residual factors for significantly intense reflections: 0.0771
• Weighted residual factors for all reflections included in the refinement: 0.082
• Goodness-of-fit parameter for all reflections included in the refinement: 1.112
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No