Information card for entry 7115501

Structure parameters

• Formula: C27 H35 N O Si
• Calculated formula: C27 H35 N O Si
• SMILES: c1ccccc1c1ccc(cc1)/C(NC(=O)C)=C/C#C[Si](C(C)C)(C(C)C)C(C)C
• Title of publication: Rhodium(III)-catalyzed olefinic C-H alkynylation of enamides at room temperature
• Authors of publication: Chao Feng; Daming Feng; Teck-Peng Loh
• Journal of publication: Chem.Commun.
• Year of publication: 2014
• Journal volume: 50
• Pages of publication: 9865
• a: 11.569 ± 0.0011 Å
• b: 9.0333 ± 0.0009 Å
• c: 46.939 ± 0.005 Å
• α: 90°
• β: 95.9944 ± 0.0013°
• γ: 90°
• Cell volume: 4878.6 ± 0.8 ų
• Cell temperature: 103 ± 2 K
• Ambient diffraction temperature: 103 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0587
• Residual factor for significantly intense reflections: 0.0458
• Weighted residual factors for significantly intense reflections: 0.1005
• Weighted residual factors for all reflections included in the refinement: 0.1069
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No