Information card for entry 7711412

Structure parameters

• Formula: C172.5 H311 Cl Cu20 N10 O20 Si20
• Calculated formula: C172.5 H311 Cl Cu20 N10 O20 Si20
• Title of publication: Cuproussiloxane as two self-assemblies, Cu₂₀O₂₀Si₁₀Me₁₀R₁₀ and Cu₂₄O₂₄Si₁₂Me₁₂R₁₂, with catalytic property.
• Authors of publication: Jiang, Wenjun; Wang, Jinjin; Chen, Yilin; Chen, Zhikang; Li, Jiancheng; Jiang, Liuyin; Peng, Yanbo; Zhu, Hongping
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2022
• Journal volume: 51
• Journal issue: 33
• Pages of publication: 12432 - 12435
• a: 17.9559 ± 0.0004 Å
• b: 34.2763 ± 0.0008 Å
• c: 39.5585 ± 0.001 Å
• α: 90°
• β: 101.029 ± 0.002°
• γ: 90°
• Cell volume: 23897.1 ± 1 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173.15 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1065
• Residual factor for significantly intense reflections: 0.0585
• Weighted residual factors for significantly intense reflections: 0.1217
• Weighted residual factors for all reflections included in the refinement: 0.1389
• Goodness-of-fit parameter for all reflections included in the refinement: 1.004
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No