Information card for entry 7038995

Structure parameters

• Formula: C20 H13 O10 P3 W2
• Calculated formula: C20 H13 O10 P3 W2
• SMILES: C(#[O])[W](C#[O])(C#[O])(C#[O])(C#[O])[P]1(CC1)P(c1ccccc1)[P]1(CC1)[W](C#[O])(C#[O])(C#[O])(C#[O])C#[O]
• Title of publication: The chemistry of parent phosphiranide in the coordination sphere of tungsten.
• Authors of publication: Hao, Yanwei; Zhang, Chunli; Mei, Yanbo; Tian, Rongqiang; Duan, Zheng; Mathey, François
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 19
• Pages of publication: 8284 - 8290
• a: 13.9576 ± 0.0003 Å
• b: 13.0301 ± 0.0003 Å
• c: 29.3579 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5339.3 ± 0.2 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291.15 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0537
• Residual factor for significantly intense reflections: 0.0371
• Weighted residual factors for significantly intense reflections: 0.073
• Weighted residual factors for all reflections included in the refinement: 0.0784
• Goodness-of-fit parameter for all reflections included in the refinement: 1.183
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No