Information card for entry 4304212

Structure parameters

• Formula: C71 H165 Mn5 N O0.5 P7 Si9
• Calculated formula: C71 H165 Mn5 N O0.5 P7 Si9
• Title of publication: Unique Manganese Phosphorus Complex with a Mn5P7 Core: Synthesis, Molecular Structure, and Magnetic Properties
• Authors of publication: Carsten von Hänisch; Florian Weigend; Rodolphe Clérac
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 1460 - 1464
• a: 14.567 ± 0.003 Å
• b: 17.121 ± 0.003 Å
• c: 21.248 ± 0.004 Å
• α: 96.01 ± 0.03°
• β: 91.81 ± 0.03°
• γ: 99.59 ± 0.03°
• Cell volume: 5190 ± 1.8 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0861
• Residual factor for significantly intense reflections: 0.0684
• Weighted residual factors for significantly intense reflections: 0.1855
• Weighted residual factors for all reflections included in the refinement: 0.2043
• Goodness-of-fit parameter for all reflections included in the refinement: 0.987
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No