Information card for entry 7708476

Structure parameters

• Formula: C100 H119.96 Ag12 N28 O36 S14
• Calculated formula: C100 H119.964 Ag12 N28 O36 S14
• Title of publication: Ensembles from Silver Clusters and Cucurbit[6]urils-contained Linkers
• Authors of publication: Li, Na-Na; Yang, Ming; Xu, Xiao-Jie; Dong, Xi-Yan; Li, Si; Zang, Shuang-Quan
• Journal of publication: Dalton Transactions
• Year of publication: 2021
• a: 14.7785 ± 0.0017 Å
• b: 15.0645 ± 0.0013 Å
• c: 29.008 ± 0.003 Å
• α: 90°
• β: 92.988 ± 0.01°
• γ: 90°
• Cell volume: 6449.3 ± 1.1 ų
• Cell temperature: 200 ± 0.1 K
• Ambient diffraction temperature: 200 ± 0.1 K
• Number of distinct elements: 6
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.1558
• Residual factor for significantly intense reflections: 0.1317
• Weighted residual factors for significantly intense reflections: 0.343
• Weighted residual factors for all reflections included in the refinement: 0.3621
• Goodness-of-fit parameter for all reflections included in the refinement: 1.072
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No