Information card for entry 4309925

Structure parameters

• Common name: [(Mn(PaPy3))2(mu-O)](ClO4)2 . 2.7CH2Cl2 . 0.5CH3CN
• Formula: C43.7 H48.4 Cl7.4 Mn2 N10.5 O11
• Calculated formula: C43.7 H44 Cl7.4 Mn2 N10.5 O11
• Title of publication: Reductive Nitrosylation and Proton-Assisted Bridge Splitting of a (μ-Oxo)dimanganese(III) Complex Derived from a Polypyridine Ligand with One Carboxamide Group
• Authors of publication: Kaushik Ghosh; Aura A. Eroy-Reveles; Marilyn M. Olmstead; Pradip K. Mascharak
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Pages of publication: 8469 - 8475
• a: 17.112 ± 0.003 Å
• b: 13.682 ± 0.003 Å
• c: 22.511 ± 0.005 Å
• α: 90°
• β: 106.344 ± 0.009°
• γ: 90°
• Cell volume: 5057.4 ± 1.8 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0885
• Residual factor for significantly intense reflections: 0.0615
• Weighted residual factors for significantly intense reflections: 0.156
• Weighted residual factors for all reflections included in the refinement: 0.1791
• Goodness-of-fit parameter for all reflections included in the refinement: 1.065
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No