Information card for entry 2241830

Structure parameters

• Chemical name: [μ-Ethane-1,2-diylbis(diphenylphosphane)-κ^2^<i>P</i>:<i>P</i>']bis[pentacarbonyltungsten(0)]
• Formula: C36 H24 O10 P2 W2
• Calculated formula: C36 H24 O10 P2 W2
• SMILES: c1(ccccc1)[P](c1ccccc1)([W](C#[O])(C#[O])(C#[O])(C#[O])C#[O])CC[P](c1ccccc1)(c1ccccc1)[W](C#[O])(C#[O])(C#[O])(C#[O])C#[O]
• Title of publication: Crystal structure of (OC)~5~W(μ-dppe)W(CO)~5~
• Authors of publication: Drake, Hannah F.; Wheeler, Kraig A.; Bellott, Brian J.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2016
• Journal volume: 72
• Journal issue: 10
• Pages of publication: 1383 - 1385
• a: 9.8193 ± 0.0004 Å
• b: 16.0492 ± 0.0007 Å
• c: 11.3312 ± 0.0005 Å
• α: 90°
• β: 96.511 ± 0.002°
• γ: 90°
• Cell volume: 1774.19 ± 0.13 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• 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: 0.0239
• Residual factor for significantly intense reflections: 0.0206
• Weighted residual factors for significantly intense reflections: 0.0465
• Weighted residual factors for all reflections included in the refinement: 0.0478
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes