Information card for entry 1574302

Structure parameters

• Formula: C36 H38 N3 O3 P Si
• Calculated formula: C36 H38 N3 O3 P Si
• SMILES: [Si]12(OC(=O)O1)([N](=C(c1ccccc1)N2C(C)(C)C)C(C)(C)C)C(=P(c1ccccc1)(c1ccccc1)c1ccccc1)C#N
• Title of publication: Base-stabilized acyclic amino(ylidyl)silylenes: electron-rich donors for the stabilization of silicon-element multiple bonds
• Authors of publication: Krischer, Felix; Mayer, Stephan; Hensle, Lennart; Knyszek, Daniel; Darmandeh, Heidar; Gessner, Viktoria H.
• Journal of publication: Chemical Science
• Year of publication: 2025
• Journal volume: 16
• Journal issue: 19
• Pages of publication: 8346 - 8356
• a: 11.7868 ± 0.0001 Å
• b: 18.1246 ± 0.0001 Å
• c: 14.9114 ± 0.0001 Å
• α: 90°
• β: 98.034 ± 0.001°
• γ: 90°
• Cell volume: 3154.27 ± 0.04 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0378
• Residual factor for significantly intense reflections: 0.0341
• Weighted residual factors for significantly intense reflections: 0.0895
• Weighted residual factors for all reflections included in the refinement: 0.0921
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No