Information card for entry 7243740

Structure parameters

• Chemical name: SiWCu
• Formula: C18 H67 Cu3 K3 N24 O76 Si W12
• Calculated formula: C18 H18 Cu3 K3 N24 O76 Si W12
• Title of publication: Polyoxometalate-based supramolecular porous frameworks with dual-active centers towards highly efficient synthesis of functionalized p-benzoquinones
• Authors of publication: Chang, Shenzhen; Chen, Yanhong; An, Haiyan; Zhu, Qingshan; Luo, Huiyun; Huang, Yaohui
• Journal of publication: Green Chemistry
• Year of publication: 2021
• Journal volume: 23
• Journal issue: 21
• Pages of publication: 8591 - 8603
• a: 15.57 ± 0.003 Å
• b: 15.57 ± 0.003 Å
• c: 10.337 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 2170.2 ± 0.9 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 8
• Space group number: 147
• Hermann-Mauguin space group symbol: P -3
• Hall space group symbol: -P 3
• Residual factor for all reflections: 0.0475
• Residual factor for significantly intense reflections: 0.0445
• Weighted residual factors for significantly intense reflections: 0.1258
• Weighted residual factors for all reflections included in the refinement: 0.1284
• Goodness-of-fit parameter for all reflections included in the refinement: 1.075
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No