Information card for entry 2215096

Structure parameters

• Chemical name: Poly[[hexaaquabis(μ~3~-trans-propene-1,2,3-tricarboxylato)trimanganese(II)] 0.2-hydrate]
• Formula: C12 H18.4 Mn3 O18.2
• Calculated formula: C12 H18.4 Mn3 O18.2
• Title of publication: Poly[[hexaaquabis(μ~3~-<i>trans</i>-propene-1,2,3-tricarboxylato)trimanganese(II)] 0.2-hydrate]
• Authors of publication: Ming-Sheng Wang; Guo-Wei Zhou; Guo-Cong Guo; Jin-Shun Huang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 9
• Pages of publication: m2400 - m2400
• a: 17.092 ± 0.007 Å
• b: 9.602 ± 0.002 Å
• c: 13.897 ± 0.005 Å
• α: 90°
• β: 116.367 ± 0.014°
• γ: 90°
• Cell volume: 2043.5 ± 1.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• 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: 0.0666
• Residual factor for significantly intense reflections: 0.0525
• Weighted residual factors for significantly intense reflections: 0.0719
• Weighted residual factors for all reflections included in the refinement: 0.0759
• Goodness-of-fit parameter for all reflections included in the refinement: 1.245
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes