Information card for entry 4304524

Structure parameters

• Formula: C28 H32 Cl Mn3 N9 O13
• Calculated formula: C28 H32 Cl Mn3 N9 O12.839
• Title of publication: Employment of 2,6-Diacetylpyridine Dioxime as a New Route to High Nuclearity Metal Clusters: Mn6 and Mn8 Complexes
• Authors of publication: Theocharis C. Stamatatos; Brian S. Luisi; Brian Moulton; George Christou
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 1134 - 1144
• a: 11.3405 ± 0.0015 Å
• b: 13.0773 ± 0.0018 Å
• c: 13.6561 ± 0.0019 Å
• α: 66.664 ± 0.002°
• β: 79.922 ± 0.002°
• γ: 83.865 ± 0.002°
• Cell volume: 1829.3 ± 0.4 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0621
• Residual factor for significantly intense reflections: 0.0517
• Weighted residual factors for significantly intense reflections: 0.1305
• Weighted residual factors for all reflections included in the refinement: 0.1394
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No