Information card for entry 2238138

Structure parameters

• Chemical name: Poly[hexaaqua(μ~9~-cyclohexane-1,2,3,4,5,6-hexacarboxylato)trimanganese(II)]
• Formula: C12 H18 Mn3 O18
• Calculated formula: C12 H18 Mn3 O18
• Title of publication: Poly[hexaaqua(μ~9~-cyclohexane-1,2,3,4,5,6-hexacarboxylato)trimanganese(II)]
• Authors of publication: Sun, Weixuan; Zang, Hu; Quan, Chengshi
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2013
• Journal volume: 69
• Journal issue: 7
• Pages of publication: m384
• a: 14.5432 ± 0.0004 Å
• b: 14.5432 ± 0.0004 Å
• c: 14.9445 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 2737.4 ± 0.2 ų
• Cell temperature: 185 ± 2 K
• Ambient diffraction temperature: 185 ± 2 K
• Number of distinct elements: 4
• Space group number: 148
• Hermann-Mauguin space group symbol: R -3 :H
• Hall space group symbol: -R 3
• Residual factor for all reflections: 0.0278
• Residual factor for significantly intense reflections: 0.025
• Weighted residual factors for significantly intense reflections: 0.0628
• Weighted residual factors for all reflections included in the refinement: 0.064
• Goodness-of-fit parameter for all reflections included in the refinement: 1.08
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes