Information card for entry 7123559

Structure parameters

• Formula: C50 H106 Ba13 Cl34 N10 O78 Sb36
• Calculated formula: C30 H36 Ba13 Cl34 N6 O54 Sb36
• Title of publication: [Ba13Sb36Cl34O54]8-: High-nuclearity cluster for the assembly of nanocluster-based compounds
• Authors of publication: Wu, Zhao-Feng; Hu, Bing; Fu, Zhi-hua; Wang, Hao; Xu, Gang; Gong, Liaokuo; Zou, Guo-Dong; Huang, Xiao-ying; Li, Jing
• Journal of publication: Chemical Communications
• Year of publication: 2019
• a: 22.1076 ± 0.0008 Å
• b: 23.5213 ± 0.0008 Å
• c: 35.8807 ± 0.0014 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 18657.9 ± 1.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 69
• Hermann-Mauguin space group symbol: F m m m
• Hall space group symbol: -F 2 2
• Residual factor for all reflections: 0.0789
• Residual factor for significantly intense reflections: 0.0722
• Weighted residual factors for significantly intense reflections: 0.1687
• Weighted residual factors for all reflections included in the refinement: 0.1732
• Goodness-of-fit parameter for all reflections included in the refinement: 1.077
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No