Information card for entry 1544436

Structure parameters

• Common name: (H2dab)[Mn2(ox)3].6H2O
• Chemical name: Poly[butane-1,4-diammonium [tri-μ-oxalato-dimanganese(II)] hexahydrate]
• Formula: C10 H26 Mn2 N2 O18
• Calculated formula: C10 H26 Mn2 N2 O18
• Title of publication: Poly[butane-1,4-diammonium [tri-μ-oxalato-dimanganese(II)] hexahydrate]
• Authors of publication: Sadakiyo, Masaaki; Yamada, Teppei; Kitagawa, Hiroshi
• Journal of publication: IUCrData
• Year of publication: 2016
• Journal volume: 1
• Journal issue: 11
• Pages of publication: x161639
• a: 8.2623 ± 0.0008 Å
• b: 16.1821 ± 0.0015 Å
• c: 9.4702 ± 0.0009 Å
• α: 90°
• β: 111.917 ± 0.001°
• γ: 90°
• Cell volume: 1174.66 ± 0.19 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.024
• Residual factor for significantly intense reflections: 0.0222
• Weighted residual factors for significantly intense reflections: 0.0546
• Weighted residual factors for all reflections included in the refinement: 0.0562
• Goodness-of-fit parameter for all reflections included in the refinement: 1.071
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes