Information card for entry 4078650

Structure parameters

• Formula: C20 H27 O6 P Si2 W
• Calculated formula: C20 H27 O6 P Si2 W
• SMILES: [C@H]1(Cc2ccccc2)O[P@@]1(C([Si](C)(C)C)[Si](C)(C)C)[W](C#[O])(C#[O])(C#[O])(C#[O])C#[O].[C@@H]1(Cc2ccccc2)O[P@]1(C([Si](C)(C)C)[Si](C)(C)C)[W](C#[O])(C#[O])(C#[O])(C#[O])C#[O]
• Title of publication: Probing the Group Tolerance of a Li/Cl Phosphinidenoid Complex Using Alkenyl-Substituted Aldehydes
• Authors of publication: Streubel, Rainer; Klein, Melina; Schnakenburg, Gregor
• Journal of publication: Organometallics
• Year of publication: 2012
• Journal volume: 31
• Journal issue: 13
• Pages of publication: 4711
• a: 9.1156 ± 0.0009 Å
• b: 10.8683 ± 0.0007 Å
• c: 13.3557 ± 0.0013 Å
• α: 77.712 ± 0.006°
• β: 81.12 ± 0.004°
• γ: 88.288 ± 0.006°
• Cell volume: 1277.3 ± 0.2 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0509
• Residual factor for significantly intense reflections: 0.0369
• Weighted residual factors for significantly intense reflections: 0.0797
• Weighted residual factors for all reflections included in the refinement: 0.0839
• Goodness-of-fit parameter for all reflections included in the refinement: 0.986
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No