Information card for entry 4075527

Structure parameters

• Formula: C23 H37 N2 O7 P Si2 W
• Calculated formula: C23 H37 N2 O7 P Si2 W
• SMILES: [W]([P]1(N=C(N2CCCCC2)C(C1)C(=O)OCC)C([Si](C)(C)C)[Si](C)(C)C)(C#[O])(C#[O])(C#[O])(C#[O])C#[O]
• Title of publication: 1,2-Azaphosphol-5-ene Complexes through Metal-Assisted Synthesis
• Authors of publication: Streubel, Rainer; Wilkens, Hendrik; Ruthe, Frank; Jones, Peter G.
• Journal of publication: Organometallics
• Year of publication: 2006
• Journal volume: 25
• Journal issue: 20
• Pages of publication: 4830
• a: 10.049 ± 0.003 Å
• b: 17.105 ± 0.004 Å
• c: 17.623 ± 0.01 Å
• α: 90°
• β: 95.5 ± 0.04°
• γ: 90°
• Cell volume: 3015 ± 2 ų
• Cell temperature: 143 ± 2 K
• Ambient diffraction temperature: 143 ± 2 K
• Number of distinct elements: 7
• 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: 0.0422
• Residual factor for significantly intense reflections: 0.0329
• Weighted residual factors for significantly intense reflections: 0.0768
• Weighted residual factors for all reflections included in the refinement: 0.0822
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No