Information card for entry 7052191

Structure parameters

• Formula: C45 H81 Cl2 O20 V5
• Calculated formula: C45 H81 Cl2 O20 V5
• Title of publication: Solid state synthesis of [V5O2(Me3CCO2)9Cl2]
• Authors of publication: Sañudo, E. Carolina; Ribas, Joan; Winpenny, Richard E. P.
• Journal of publication: New Journal of Chemistry
• Year of publication: 2007
• Journal volume: 31
• Journal issue: 8
• Pages of publication: 1421
• a: 14.294 ± 0.001 Å
• b: 14.848 ± 0.001 Å
• c: 16.671 ± 0.007 Å
• α: 65.42 ± 0.02°
• β: 86.24 ± 0.02°
• γ: 84.8 ± 0.01°
• Cell volume: 3202.8 ± 1.5 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.075
• Residual factor for significantly intense reflections: 0.0478
• Weighted residual factors for significantly intense reflections: 0.1195
• Weighted residual factors for all reflections included in the refinement: 0.1349
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.6933 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No