Information card for entry 4064933

Structure parameters

• Formula: C16 H25 O6 P Si2 W
• Calculated formula: C16 H25 O6 P Si2 W
• SMILES: C12(CCC1)O[P]2(C([Si](C)(C)C)[Si](C)(C)C)[W](C#[O])(C#[O])(C#[O])(C#[O])C#[O]
• Title of publication: First Examples of Spirooxaphosphirane Complexes
• Authors of publication: Pérez, Janaina Marinas; Klein, Melina; Kyri, Andreas Wolfgang; Schnakenburg, Gregor; Streubel, Rainer
• Journal of publication: Organometallics
• Year of publication: 2011
• Journal volume: 30
• Journal issue: 21
• Pages of publication: 5636
• a: 10.7439 ± 0.0003 Å
• b: 15.2447 ± 0.0003 Å
• c: 16.2191 ± 0.0004 Å
• α: 113.999 ± 0.0012°
• β: 102.922 ± 0.0013°
• γ: 99.5701 ± 0.0013°
• Cell volume: 2264.55 ± 0.1 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: 0.0302
• Residual factor for significantly intense reflections: 0.0241
• Weighted residual factors for significantly intense reflections: 0.0569
• Weighted residual factors for all reflections included in the refinement: 0.0585
• Goodness-of-fit parameter for all reflections included in the refinement: 1.015
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No