Information card for entry 7015432

Structure parameters

• Formula: C70 H92 Cl Mn13 N8 O52
• Calculated formula: C70 H92 Cl Mn13 N8 O52
• Title of publication: New high-nuclearity manganese clusters containing mixed chelating ligands: syntheses, crystal structures and magnetochemical characterization.
• Authors of publication: Wang, Hui-Sheng; Zhang, Zai-Chao; Song, Xiao-Jiao; Zhang, Jing-Wei; Zhou, Hong-Bo; Wang, Jun; Song, You; You, Xiao-Zeng
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 12
• Pages of publication: 2703 - 2706
• a: 37.535 ± 0.0017 Å
• b: 13.922 ± 0.0013 Å
• c: 23.724 ± 0.002 Å
• α: 90°
• β: 94.691 ± 0.003°
• γ: 90°
• Cell volume: 12355.7 ± 1.7 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0626
• Residual factor for significantly intense reflections: 0.0456
• Weighted residual factors for significantly intense reflections: 0.1016
• Weighted residual factors for all reflections included in the refinement: 0.1059
• 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: No
• Has Fobs: No