Information card for entry 2216004

Structure parameters

• Chemical name: Hexaaquamanganese(II) bis(4-methylbenzenesulfonate)
• Formula: C14 H26 Mn O12 S2
• Title of publication: Hexaaquamanganese(II) bis(4-methylbenzenesulfonate)
• Authors of publication: Zhong, H.; Yang, X.-M.; Xie, H.-L.; Luo, C.-J.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 11
• Pages of publication: m2825
• a: 7.002 ± 0.002 Å
• b: 6.0153 ± 0.0017 Å
• c: 24.9011 ± 0.0011 Å
• α: 90°
• β: 90.997 ± 0.005°
• γ: 90°
• Cell volume: 1048.7 ± 0.4 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 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: 0.0458
• Residual factor for significantly intense reflections: 0.0409
• Weighted residual factors for significantly intense reflections: 0.1147
• Weighted residual factors for all reflections included in the refinement: 0.1175
• Goodness-of-fit parameter for all reflections included in the refinement: 1.005
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: No
• Has disorder: No
• Has Fobs: Yes