Information card for entry 4035790

Structure parameters

• Formula: C24 H31 N O2 Si
• Calculated formula: C24 H31 N O2 Si
• SMILES: [Si](/C(=C\N1[C@@H](Cc2ccccc2)COC1=O)c1ccccc1)(CC)(CC)CC
• Title of publication: Rhodium-Catalyzed Highly Regioselective and Stereoselective Intermolecular Hydrosilylation of Internal Ynamides under Mild Conditions.
• Authors of publication: Zheng, Nan; Song, Wangze; Zhang, Tiexin; Li, Ming; Zheng, Yubin; Chen, Lingyue
• Journal of publication: The Journal of organic chemistry
• Year of publication: 2018
• Journal volume: 83
• Journal issue: 11
• Pages of publication: 6210 - 6216
• a: 8.1721 ± 0.0003 Å
• b: 10.6004 ± 0.0005 Å
• c: 13.6501 ± 0.0005 Å
• α: 90°
• β: 95.223 ± 0.003°
• γ: 90°
• Cell volume: 1177.56 ± 0.08 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0402
• Residual factor for significantly intense reflections: 0.0346
• Weighted residual factors for significantly intense reflections: 0.0839
• Weighted residual factors for all reflections included in the refinement: 0.0874
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No