Information card for entry 1556166

Structure parameters

• Formula: C17 H24 N2 O Si
• Calculated formula: C17 H24 N2 O Si
• SMILES: [Si](O[C@@]12[C@H]3N=NC[C@H]3C[C@H]1CCc1ccccc21)(C)(C)C.[Si](O[C@]12[C@@H]3N=NC[C@@H]3C[C@@H]1CCc1ccccc21)(C)(C)C
• Title of publication: Sequential reactions of trimethylsilyldiazomethane with 4-alkenyl ketones and aldehydes catalyzed by Lewis bases.
• Authors of publication: Liu, Huaqing; O'Connor, Matthew J; Sun, Chunrui; Wink, Donald J.; Lee, Daesung
• Journal of publication: Organic letters
• Year of publication: 2013
• Journal volume: 15
• Journal issue: 12
• Pages of publication: 2974 - 2977
• a: 13.2419 ± 0.0016 Å
• b: 8.6081 ± 0.001 Å
• c: 15.4864 ± 0.0019 Å
• α: 90°
• β: 109.76 ± 0.001°
• γ: 90°
• Cell volume: 1661.3 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0482
• Residual factor for significantly intense reflections: 0.035
• Weighted residual factors for significantly intense reflections: 0.113
• Weighted residual factors for all reflections included in the refinement: 0.1249
• Goodness-of-fit parameter for all reflections included in the refinement: 0.947
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No