Information card for entry 4070277

Structure parameters

• Formula: C26 H25 N O10 P2 W2
• Calculated formula: C26 H25 N O10 P2 W2
• SMILES: [W](C#[O])(C#[O])(C#[O])(C#[O])(C#[O])[P@]1(C(=C(c2ccccc2)[P@@]1([W](C#[O])(C#[O])(C#[O])(C#[O])C#[O])C)N(C(C)C)C(C)C)C.[W](C#[O])(C#[O])(C#[O])(C#[O])(C#[O])[P@@]1(C(=C(c2ccccc2)[P@]1([W](C#[O])(C#[O])(C#[O])(C#[O])C#[O])C)N(C(C)C)C(C)C)C
• Title of publication: Synthesis, Structure, and Chemistry of 2-Amino-Substituted Phosphirenes
• Authors of publication: Panichakul, Duanghathai; Mathey, François
• Journal of publication: Organometallics
• Year of publication: 2009
• Journal volume: 28
• Journal issue: 19
• Pages of publication: 5705
• a: 13.2742 ± 0.0004 Å
• b: 12.2704 ± 0.0004 Å
• c: 20.125 ± 0.0006 Å
• α: 90°
• β: 108.164 ± 0.002°
• γ: 90°
• Cell volume: 3114.61 ± 0.17 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 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: 0.0442
• Residual factor for significantly intense reflections: 0.0262
• Weighted residual factors for significantly intense reflections: 0.0677
• Weighted residual factors for all reflections included in the refinement: 0.0888
• Goodness-of-fit parameter for all reflections included in the refinement: 1.19
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No