Information card for entry 1547717

Structure parameters

• Formula: C24 H38 O2 Si
• Calculated formula: C24 H38 O2 Si
• SMILES: [Si](OC1=C[C@@H]([C@H]([C@@H]([C@@H]1[C@@H](c1ccccc1)C)C)C(=O)C)C)(C)(C)C(C)(C)C.[Si](OC1=C[C@H]([C@@H]([C@H]([C@H]1[C@H](c1ccccc1)C)C)C(=O)C)C)(C)(C)C(C)(C)C
• Title of publication: Stereoselective one-pot synthesis of polypropionates
• Authors of publication: Guo-Ming Ho; Medel Manuel L. Zulueta; Shang-Cheng Hung
• Journal of publication: Nature Cummunications
• Year of publication: 2017
• Journal volume: 8
• Pages of publication: 679
• a: 7.4396 ± 0.0003 Å
• b: 11.7668 ± 0.0005 Å
• c: 14.4083 ± 0.0006 Å
• α: 67.38 ± 0.003°
• β: 84.506 ± 0.003°
• γ: 83.796 ± 0.003°
• Cell volume: 1155.44 ± 0.09 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0637
• Residual factor for significantly intense reflections: 0.0422
• Weighted residual factors for significantly intense reflections: 0.0928
• Weighted residual factors for all reflections included in the refinement: 0.1044
• Goodness-of-fit parameter for all reflections included in the refinement: 1.016
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No