Information card for entry 4081582

Structure parameters

• Formula: C18 H8 O10 P2 S2 W2
• Calculated formula: C18 H8 O10 P2 S2 W2
• SMILES: [W]([P@@H]([P@H]([W](C#[O])(C#[O])(C#[O])(C#[O])C#[O])c1sccc1)c1sccc1)(C#[O])(C#[O])(C#[O])(C#[O])C#[O].[W]([P@H]([P@@H]([W](C#[O])(C#[O])(C#[O])(C#[O])C#[O])c1sccc1)c1sccc1)(C#[O])(C#[O])(C#[O])(C#[O])C#[O]
• Title of publication: Simple Access to Tungsten-Stabilized Disecondary Diphosphines
• Authors of publication: Tian, Rongqiang; Mei, Yanbo; Duan, Zheng; Mathey, François
• Journal of publication: Organometallics
• Year of publication: 2013
• Journal volume: 32
• Journal issue: 19
• Pages of publication: 5615
• a: 10.9195 ± 0.0003 Å
• b: 12.807 ± 0.0003 Å
• c: 21.7839 ± 0.0007 Å
• α: 90°
• β: 103.73 ± 0.003°
• γ: 90°
• Cell volume: 2959.34 ± 0.15 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291.15 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0532
• Residual factor for significantly intense reflections: 0.0348
• Weighted residual factors for significantly intense reflections: 0.0742
• Weighted residual factors for all reflections included in the refinement: 0.0793
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No