Information card for entry 4311427

Structure parameters

• Formula: C20 H50 Cu4 N O6 P3 S10 W
• Calculated formula: C20 H50 Cu4 N O6 P3 S10 W
• Title of publication: Construction of a Novel Mo/Cu/S Cluster with a Closed Double-Cubane-like Polyhedron and a Chain Polymer of W/Cu/S Clusters
• Authors of publication: Zhihua Li; Shaowu Du; Xintao Wu
• Journal of publication: Inorganic Chemistry
• Year of publication: 2004
• Journal volume: 43
• Pages of publication: 4776 - 4777
• a: 7.682 ± 0.003 Å
• b: 21.914 ± 0.009 Å
• c: 25.581 ± 0.011 Å
• α: 90°
• β: 92.698 ± 0.004°
• γ: 90°
• Cell volume: 4302 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 8
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for significantly intense reflections: 0.0724
• Weighted residual factors for significantly intense reflections: 0.1541
• Weighted residual factors for all reflections included in the refinement: 0.1697
• Goodness-of-fit parameter for all reflections included in the refinement: 1.11
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No