Information card for entry 4507943

Structure parameters

• Formula: C48 H49 B Cu2 N12 O44 W12
• Calculated formula: C48 H48 B Cu2 N12 O44 W12
• Title of publication: Polyoxometalate-Induced New Self-Assemblies Based on Copper Ions and Bichelate-Bridging Ligands
• Authors of publication: Wang, Xin; Zhang, Mao-Mao; Hao, Xiu-Li; Wang, Yong-Hui; Wei, Ying; Liang, Fu-Shun; Xu, Li-Jie; Li, Yang-Guang
• Journal of publication: Crystal Growth & Design
• Year of publication: 2013
• Journal volume: 13
• Journal issue: 8
• Pages of publication: 3454
• a: 11.2615 ± 0.0006 Å
• b: 11.9601 ± 0.0006 Å
• c: 14.7931 ± 0.0006 Å
• α: 78.121 ± 0.004°
• β: 84.854 ± 0.004°
• γ: 88.142 ± 0.004°
• Cell volume: 1941.74 ± 0.17 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.0816
• Residual factor for significantly intense reflections: 0.0526
• Weighted residual factors for significantly intense reflections: 0.0927
• Weighted residual factors for all reflections included in the refinement: 0.1051
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No