Information card for entry 4317542

Structure parameters

• Formula: C67 H74 Cl8 Mn4 N O18
• Calculated formula: C64.7359 H56 Cl2.7882 Mn4 N O18
• Title of publication: Bridging Nitrate Groups in [Mn4O3(NO3)(O2CMe)3(R2dbm)3] (R = H, Et) and [Mn4O2(NO3)(O2CEt)6(bpy)2](ClO4): Acidolysis Routes to Tetranuclear Manganese Carboxylate Complexes
• Authors of publication: Guillem Aromí; Sumit Bhaduri; Pau Artús; Kirsten Folting; George Christou
• Journal of publication: Inorganic Chemistry
• Year of publication: 2002
• Journal volume: 41
• Pages of publication: 805 - 817
• a: 21.11 ± 0.003 Å
• b: 22.183 ± 0.003 Å
• c: 15.958 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 7472.9 ± 1.7 ų
• Cell temperature: 105 K
• Ambient diffraction temperature: 105 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for significantly intense reflections: 0.0748
• Weighted residual factors for all reflections included in the refinement: 0.0735
• Goodness-of-fit parameter for all reflections included in the refinement: 1.7778
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No