Information card for entry 1556167

Structure parameters

• Formula: C16 H28 N2 O3 Si
• Calculated formula: C16 H28 N2 O3 Si
• SMILES: [Si](O[C@]1(C[C@@H]2[C@]3([C@@H]1N=NC3)CCC1(OCCO1)C2)C)(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: 6.6646 ± 0.0004 Å
• b: 8.5137 ± 0.0004 Å
• c: 30.7646 ± 0.0015 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1745.6 ± 0.16 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0455
• Residual factor for significantly intense reflections: 0.0443
• Weighted residual factors for significantly intense reflections: 0.109
• Weighted residual factors for all reflections included in the refinement: 0.1096
• Goodness-of-fit parameter for all reflections included in the refinement: 1.118
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No