Information card for entry 4516281

Structure parameters

• Formula: C16 H24 Cu N8 O6 V2
• Calculated formula: C16 H24 Cu N8 O6 V2
• Title of publication: Controllable Synthesis, Characterization, and Catalytic Properties of Three Inorganic‒Organic Hybrid Copper Vanadates in the Highly Selective Oxidation of Sulfides and Alcohols
• Authors of publication: Li, Jikun; Huang, Xianqiang; Yang, Song; Xu, Yanqing; Hu, Changwen
• Journal of publication: Crystal Growth & Design
• Year of publication: 2015
• Journal volume: 15
• Journal issue: 4
• Pages of publication: 1907
• a: 10.8254 ± 0.0003 Å
• b: 16.3599 ± 0.0004 Å
• c: 12.9484 ± 0.0003 Å
• α: 90°
• β: 95.073 ± 0.001°
• γ: 90°
• Cell volume: 2284.21 ± 0.1 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0331
• Residual factor for significantly intense reflections: 0.0266
• Weighted residual factors for significantly intense reflections: 0.067
• Weighted residual factors for all reflections included in the refinement: 0.0703
• Goodness-of-fit parameter for all reflections included in the refinement: 1.019
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No