Information card for entry 7106471

Structure parameters

• Formula: C131 H268 Cl10 Mn32 O94.6
• Calculated formula: C131 H268 Cl10 Mn32 O94.6
• Title of publication: A high nuclearity mixed valence {Mn32} Cluster
• Authors of publication: Stuart K. Langley; Rachel A. Stott; Nicholas F. Chilton; Boujemaa Moubaraki; Keith S. Murray
• Journal of publication: Chem.Commun.
• Year of publication: 2011
• Journal volume: 47
• Pages of publication: 6281
• a: 20.8645 ± 0.0008 Å
• b: 20.3201 ± 0.0009 Å
• c: 27.2798 ± 0.0011 Å
• α: 90°
• β: 96.035 ± 0.001°
• γ: 90°
• Cell volume: 11501.7 ± 0.8 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 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: 0.104
• Residual factor for significantly intense reflections: 0.0812
• Weighted residual factors for significantly intense reflections: 0.1553
• Weighted residual factors for all reflections included in the refinement: 0.1672
• Goodness-of-fit parameter for all reflections included in the refinement: 1.143
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No