Information card for entry 4339698

Structure parameters

• Formula: C120 H92 Mn6 N16 O30 P4 S4
• Calculated formula: C120 H92 Mn6 N16 O30 P4 S4
• Title of publication: Novel manganese(II) sulfonate-phosphonates with dinuclear, tetranuclear, and hexanuclear clusters.
• Authors of publication: Du, Zi-Yi; Prosvirin, Andrey V.; Mao, Jiang-Gao
• Journal of publication: Inorganic chemistry
• Year of publication: 2007
• Journal volume: 46
• Journal issue: 23
• Pages of publication: 9884 - 9894
• a: 14.6347 ± 0.0001 Å
• b: 15.1733 ± 0.0003 Å
• c: 16.237 ± 0.0003 Å
• α: 112.272 ± 0.001°
• β: 93.13°
• γ: 114.91 ± 0.001°
• Cell volume: 2925.9 ± 0.09 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0392
• Residual factor for significantly intense reflections: 0.0321
• Weighted residual factors for significantly intense reflections: 0.0793
• Weighted residual factors for all reflections included in the refinement: 0.0869
• Goodness-of-fit parameter for all reflections included in the refinement: 1.099
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No