Information card for entry 2209482

Structure parameters

• Chemical name: catena-Poly[imidazolium [[diaquadichloromanganese(II)]-μ-chloro]]
• Formula: C3 H9 Cl3 Mn N2 O2
• Calculated formula: C3 H9 Cl3 Mn N2 O2
• SMILES: [Mn](Cl)(Cl)(Cl)([OH2])([OH2])[Cl][Mn](Cl)(Cl)([OH2])[OH2].[nH]1c[nH+]cc1.[nH]1c[nH+]cc1
• Title of publication: <i>catena</i>-Poly[imidazolium [[diaquadichloromanganese(II)]-μ-chloro]]
• Authors of publication: Zhang, Hui; Wu, Yan-Mei; Fang, Liang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 7
• Pages of publication: m1459 - m1461
• a: 11.623 ± 0.006 Å
• b: 9.354 ± 0.005 Å
• c: 9.114 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 990.9 ± 0.9 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 29
• Hermann-Mauguin space group symbol: P c a 21
• Hall space group symbol: P 2c -2ac
• Residual factor for all reflections: 0.0209
• Residual factor for significantly intense reflections: 0.0192
• Weighted residual factors for significantly intense reflections: 0.0455
• Weighted residual factors for all reflections included in the refinement: 0.0459
• Goodness-of-fit parameter for all reflections included in the refinement: 1.006
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes