Information card for entry 4309924

Structure parameters

• Common name: [Mn(PaPy3)(OOC6H5)](ClO4).CH2Cl2
• Formula: C28 H27 Cl3 Mn N5 O7
• Calculated formula: C28 H27 Cl3 Mn N5 O7
• 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: 11.2904 ± 0.0009 Å
• b: 17.3599 ± 0.0013 Å
• c: 17.875 ± 0.0013 Å
• α: 110.209 ± 0.004°
• β: 105.526 ± 0.002°
• γ: 102.543 ± 0.003°
• Cell volume: 2976.3 ± 0.4 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 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: 0.0907
• Residual factor for significantly intense reflections: 0.0524
• Weighted residual factors for significantly intense reflections: 0.125
• Weighted residual factors for all reflections included in the refinement: 0.1471
• Goodness-of-fit parameter for all reflections included in the refinement: 0.995
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No