Information card for entry 4315239

Structure parameters

• Formula: C62 H55 As2 Mn3.5 N10 O18 S2
• Calculated formula: C65.5 H44 As2 Mn3.5 N9.5 O18 S2
• Title of publication: A Series of New Manganese(II) Sulfonate-Arsonates with 2D Layer, 1D Chain, and 0D Clusters Structures
• Authors of publication: Fei-Yan Yi; Qi-Pu Lin; Tian-Hua Zhou; Jiang-Gao Mao
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 3489 - 3500
• a: 20.48 ± 0.03 Å
• b: 14.63 ± 0.006 Å
• c: 24.14 ± 0.02 Å
• α: 90°
• β: 97.189 ± 0.015°
• γ: 90°
• Cell volume: 7176 ± 12 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/n 1
• Hall space group symbol: -P 2yac
• Residual factor for all reflections: 0.1265
• Residual factor for significantly intense reflections: 0.0946
• Weighted residual factors for significantly intense reflections: 0.2433
• Weighted residual factors for all reflections included in the refinement: 0.2672
• Goodness-of-fit parameter for all reflections included in the refinement: 1.159
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No