Information card for entry 4071851

Structure parameters

• Common name: 12a
• Formula: C25 H28 N4 O2 Si
• Calculated formula: C25 H28 N4 O2 Si
• SMILES: c1ccccc1C1=N[N]2=C3CCCC3C3(CCCC3)N3N=C(c4ccccc4)O[Si]23(C)O1
• Title of publication: Hydride Migration from Silicon to an Adjacent Unsaturated Imino Carbon: Intramolecular Hydrosilylation
• Authors of publication: Kertsnus-Banchik, Evgenia; Kalikhman, Inna; Gostevskii, Boris; Deutsch, Zvicka; Botoshansky, Mark; Kost, Daniel
• Journal of publication: Organometallics
• Year of publication: 2008
• Journal volume: 27
• Journal issue: 20
• Pages of publication: 5285
• a: 9.0893 ± 0.0018 Å
• b: 20.272 ± 0.004 Å
• c: 12.872 ± 0.003 Å
• α: 90°
• β: 103.255 ± 0.003°
• γ: 90°
• Cell volume: 2308.6 ± 0.8 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 2 K
• Number of distinct elements: 5
• 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: 0.083
• Residual factor for significantly intense reflections: 0.0479
• Weighted residual factors for significantly intense reflections: 0.1163
• Weighted residual factors for all reflections included in the refinement: 0.1317
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No