Information card for entry 4500692

Structure parameters

• Formula: C26 H93 Cu3.5 N18 O86.5 P2 Pr W22
• Calculated formula: C26 H72 Cu3.5 N18 O86.5 P2 Pr W22
• Title of publication: 1-D, 2-D, and 3-D Organic‒Inorganic Hybrids Assembled from Keggin-type Polyoxometalates and 3d-4f Heterometals
• Authors of publication: Niu, Jingyang; Zhang, Shaowei; Chen, Huanni; Zhao, Junwei; Ma, Pengtao; Wang, Jingping
• Journal of publication: Crystal Growth & Design
• Year of publication: 2011
• Journal volume: 11
• Journal issue: 9
• Pages of publication: 3769
• a: 13.0173 ± 0.0006 Å
• b: 19.3803 ± 0.0009 Å
• c: 21.5028 ± 0.0009 Å
• α: 96.007 ± 0.001°
• β: 95.311 ± 0.001°
• γ: 95.713 ± 0.001°
• Cell volume: 5339 ± 0.4 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0669
• Residual factor for significantly intense reflections: 0.044
• Weighted residual factors for significantly intense reflections: 0.0866
• Weighted residual factors for all reflections included in the refinement: 0.0932
• Goodness-of-fit parameter for all reflections included in the refinement: 1.016
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No