Information card for entry 7123051

Structure parameters

• Formula: C28 H47 N3 O Si3
• Calculated formula: C28 H47 N3 O Si3
• Title of publication: Silylene induced cooperative B‒H bond activation and unprecedented aldehyde C‒H bond splitting with amidinate ring expansion
• Authors of publication: Roesky, Herbert W.; Swamy, V S. V. S. N.; Vanka, Kumar; Raj, K. Vipin; Sen, Sakya Singha
• Journal of publication: Chemical Communications
• Year of publication: 2019
• a: 10.8132 ± 0.0014 Å
• b: 10.9099 ± 0.0013 Å
• c: 13.5038 ± 0.0017 Å
• α: 80.743 ± 0.003°
• β: 78.036 ± 0.003°
• γ: 79.717 ± 0.003°
• Cell volume: 1520.7 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1084
• Residual factor for significantly intense reflections: 0.0535
• Weighted residual factors for significantly intense reflections: 0.088
• Weighted residual factors for all reflections included in the refinement: 0.1049
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No