Information card for entry 4312442

Structure parameters

• Formula: C57 H65 Cl11 Mn7 N9 O17
• Calculated formula: C57 H65 Cl11 Mn7 N9 O17
• Title of publication: Heptanuclear and Decanuclear Manganese Complexes with the Anion of 2-Hydroxymethylpyridine
• Authors of publication: Nicholas C. Harden; Milissa A. Bolcar; Wolfgang Wernsdorfer; Khalil A. Abboud; William E. Streib; George Christou
• Journal of publication: Inorganic Chemistry
• Year of publication: 2003
• Journal volume: 42
• Pages of publication: 7067 - 7076
• a: 12.6352 ± 0.0006 Å
• b: 14.6413 ± 0.0007 Å
• c: 20.552 ± 0.002 Å
• α: 90.993 ± 0.002°
• β: 97.516 ± 0.002°
• γ: 91.883 ± 0.002°
• Cell volume: 3766.4 ± 0.4 ų
• Cell temperature: 133 ± 2 K
• Ambient diffraction temperature: 193 ± 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: 0.0413
• Residual factor for significantly intense reflections: 0.0319
• Weighted residual factors for significantly intense reflections: 0.0906
• Weighted residual factors for all reflections included in the refinement: 0.0978
• Goodness-of-fit parameter for all reflections included in the refinement: 1.136
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No