Information card for entry 7002691

Structure parameters

• Formula: C90 H94 Cu2 N18 O127 Si3 W36
• Calculated formula: C90 H80 Cu2 N18 O127 Si3 W36
• Title of publication: pH-dependent assembly of 0D to 3D Keggin-based coordination polymers: Structures and catalytic properties
• Authors of publication: Yu, Fan; Kong, Xiang-Jian; Zheng, Yun-Yun; Ren, Yan-Ping; Long, La-Sheng; Huang, Rong-Bin; Zheng, Lan-Sun
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 43
• Pages of publication: 9503 - 9509
• a: 12.1664 ± 0.0019 Å
• b: 17.906 ± 0.003 Å
• c: 20.973 ± 0.003 Å
• α: 68.72 ± 0.002°
• β: 86.867 ± 0.003°
• γ: 83.182 ± 0.003°
• Cell volume: 4227 ± 1.1 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0979
• Residual factor for significantly intense reflections: 0.0804
• Weighted residual factors for significantly intense reflections: 0.1688
• Weighted residual factors for all reflections included in the refinement: 0.1772
• Goodness-of-fit parameter for all reflections included in the refinement: 1.064
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No