Information card for entry 7106093

Structure parameters

• Formula: C112 H252 N7 O40 V15
• Calculated formula: C112 N7 O40 V15
• Title of publication: Tuning the light absorption of a molecular vanadium oxide system for enhanced photooxidation performance
• Authors of publication: Johannes Forster; Benedikt Rosner; Marat M. Khusniyarov; Carsten Streb
• Journal of publication: Chem.Commun.
• Year of publication: 2011
• Journal volume: 47
• Pages of publication: 3114
• a: 18.4325 ± 0.0017 Å
• b: 17.0098 ± 0.0017 Å
• c: 49.509 ± 0.003 Å
• α: 90°
• β: 97.192 ± 0.007°
• γ: 90°
• Cell volume: 15401 ± 2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• 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: 0.093
• Residual factor for significantly intense reflections: 0.0692
• Weighted residual factors for significantly intense reflections: 0.1896
• Weighted residual factors for all reflections included in the refinement: 0.2069
• Goodness-of-fit parameter for all reflections included in the refinement: 1.008
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No