Information card for entry 1556038

Structure parameters

• Formula: C26 H34 O4 Si
• Calculated formula: C26 H34 O4 Si
• SMILES: [Si]([C@](O)([C@@H](/C=C/C(=O)c1ccccc1)C)C(=O)OCc1ccccc1)(C)(C)C(C)(C)C
• Title of publication: Organocatalyzed Direct Aldol Reaction of Silyl Glyoxylates for the Synthesis of α-Hydroxysilanes.
• Authors of publication: Han, Man-Yi; Xie, Xiaoyu; Zhou, Di; Li, Pinhua; Wang, Lei
• Journal of publication: Organic letters
• Year of publication: 2017
• Journal volume: 19
• Journal issue: 9
• Pages of publication: 2282 - 2285
• a: 9.47 ± 0.0019 Å
• b: 15.075 ± 0.003 Å
• c: 17.824 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2544.6 ± 0.9 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 4
• 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: 0.0519
• Residual factor for significantly intense reflections: 0.0423
• Weighted residual factors for significantly intense reflections: 0.1132
• Weighted residual factors for all reflections included in the refinement: 0.1225
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No