Information card for entry 2020647

Structure parameters

• Chemical name: Poly[(ethane-1,2-diol-κ<i>O</i>)(μ-sulfato-κ^2^<i>O</i>:<i>O</i>'){μ~3~-1,3,5-tris[(1<i>H</i>-imidazol-1-yl)methyl]benzene-κ^3^<i>N</i>:<i>N</i>':<i>N</i>''}manganese(II)]
• Formula: C20 H24 Mn N6 O6 S
• Calculated formula: C20 H24 Mn N6 O6 S
• Title of publication: A new three-dimensional manganese(II) coordination polymer based on the 1,3,5-tris[(1<i>H</i>-imidazol-1-yl)methyl]benzene ligand
• Authors of publication: Lu, Xin-Hua; Zhong, Kai-Long
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2016
• Journal volume: 72
• Journal issue: 11
• Pages of publication: 895 - 900
• a: 8.8547 ± 0.0006 Å
• b: 9.9689 ± 0.0007 Å
• c: 12.9721 ± 0.001 Å
• α: 97.005 ± 0.001°
• β: 97.885 ± 0.001°
• γ: 90.929 ± 0.001°
• Cell volume: 1125.14 ± 0.14 ų
• Cell temperature: 223.15 K
• Ambient diffraction temperature: 223.15 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: 0.0481
• Residual factor for significantly intense reflections: 0.0368
• Weighted residual factors for significantly intense reflections: 0.0897
• Weighted residual factors for all reflections included in the refinement: 0.0962
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes