Information card for entry 7205773

Structure parameters

• Formula: C70 H72 B Cu5 N20 O41 W12
• Calculated formula: C70 H72 B Cu5 N20 O41 W12
• Title of publication: Polyoxometalate charge directed coordination assemblies: Macrocycles and polymer chains
• Authors of publication: Hou, Guangfeng; Bi, Lihua; Li, Bao; Wang, Bin; Wu, Lixin
• Journal of publication: CrystEngComm
• Year of publication: 2011
• Journal volume: 13
• Journal issue: 10
• Pages of publication: 3526
• a: 16.504 ± 0.003 Å
• b: 25.01 ± 0.005 Å
• c: 26.843 ± 0.009 Å
• α: 90°
• β: 116.46 ± 0.02°
• γ: 90°
• Cell volume: 9919 ± 5 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0712
• Residual factor for significantly intense reflections: 0.0441
• Weighted residual factors for significantly intense reflections: 0.0806
• Weighted residual factors for all reflections included in the refinement: 0.0891
• Goodness-of-fit parameter for all reflections included in the refinement: 1.022
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No