Information card for entry 4318015

Structure parameters

• Formula: C15 H15 N3 O9 P V2
• Calculated formula: C15 H15 N3 O9 P V2
• Title of publication: Novel Vanadium(V) Compounds with a Layer Structure: Synthesis, Crystal Structures, and Solid State NMR Spectroscopy of [(VO2)2(4,4'-bpy)0.5(4,4'-Hbpy)(XO4)].H2O (X = P and As)
• Authors of publication: Li-Hsun Huang; Hsien-Ming Kao; Kwang-Hwa Lii
• Journal of publication: Inorganic Chemistry
• Year of publication: 2002
• Journal volume: 41
• Pages of publication: 2936 - 2940
• a: 7.9063 ± 0.0003 Å
• b: 10.2201 ± 0.0004 Å
• c: 12.1336 ± 0.0005 Å
• α: 113.465 ± 0.0007°
• β: 95.7231 ± 0.0007°
• γ: 94.4447 ± 0.0007°
• Cell volume: 887.46 ± 0.06 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0429
• Residual factor for significantly intense reflections: 0.0353
• Weighted residual factors for significantly intense reflections: 0.0846
• Weighted residual factors for all reflections included in the refinement: 0.0879
• Goodness-of-fit parameter for all reflections included in the refinement: 1.089
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No