Information card for entry 4033731

Structure parameters

• Formula: C26 H32 Cl N O6 Si
• Calculated formula: C26 H32 Cl N O6 Si
• SMILES: Clc1ccccc1[C@@H]1N[C@H](C(=O)OC)[C@@H]([Si](C)(c2ccccc2)C)C1(C(=O)OCC)C(=O)OCC
• Title of publication: Ag(I)-Fesulphos-Catalyzed Enantioselective Synthesis of 3-Silylproline Derivatives.
• Authors of publication: Chowdhury, Raghunath; Dubey, Akhil K.; Ghosh, Sunil K.
• Journal of publication: The Journal of organic chemistry
• Year of publication: 2019
• Journal volume: 84
• Journal issue: 5
• Pages of publication: 2404 - 2414
• a: 7.4745 ± 0.0003 Å
• b: 9.6998 ± 0.0004 Å
• c: 20.0096 ± 0.001 Å
• α: 80.839 ± 0.004°
• β: 85.378 ± 0.004°
• γ: 67.764 ± 0.004°
• Cell volume: 1325.38 ± 0.11 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 6
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.1364
• Residual factor for significantly intense reflections: 0.0947
• Weighted residual factors for significantly intense reflections: 0.2179
• Weighted residual factors for all reflections included in the refinement: 0.2732
• Goodness-of-fit parameter for all reflections included in the refinement: 1.098
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No