Information card for entry 4305582

Structure parameters

• Formula: C21 H36 N8 O16 V2
• Calculated formula: C21 H36 N8 O16 V2
• Title of publication: Solid State and Aqueous Solution Characterization of Rectangular Tetranuclear VIV/V-p-Semiquinonate/Hydroquinonate Complexes Exhibiting a Proton Induced Electron Transfer
• Authors of publication: Chryssoula Drouza; Anastasios D. Keramidas
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 7211 - 7224
• a: 19.4212 ± 0.0009 Å
• b: 11.0769 ± 0.0005 Å
• c: 29.3388 ± 0.001 Å
• α: 90°
• β: 98.816 ± 0.003°
• γ: 90°
• Cell volume: 6237 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0516
• Residual factor for significantly intense reflections: 0.0432
• Weighted residual factors for significantly intense reflections: 0.119
• Weighted residual factors for all reflections included in the refinement: 0.1219
• Goodness-of-fit parameter for all reflections included in the refinement: 1.085
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No