Information card for entry 4109159

Structure parameters

• Formula: C31 H76 O3 Si8
• Calculated formula: C31 H76 O3 Si8
• SMILES: [Si]([Si]([Si](C)(C)C)([Si](C)(C)C)O[C@H](C[C@H](O[Si]([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C)C(C)(C)C)[C@H]1CCCCC1=O)(C)(C)C.[Si]([Si]([Si](C)(C)C)([Si](C)(C)C)O[C@@H](C[C@@H](O[Si]([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C)C(C)(C)C)[C@@H]1CCCCC1=O)(C)(C)C
• Title of publication: "Super Silyl" Group for Diastereoselective Sequential Reactions: Access to Complex Chiral Architecture in One Pot
• Authors of publication: Matthew B. Boxer; Hisashi Yamamoto
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2007
• Journal volume: 129
• Pages of publication: 2762 - 2763
• a: 10.13 ± 0.002 Å
• b: 17.035 ± 0.003 Å
• c: 27.695 ± 0.007 Å
• α: 90°
• β: 109.02 ± 0.03°
• γ: 90°
• Cell volume: 4518.3 ± 1.8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0633
• Residual factor for significantly intense reflections: 0.038
• Weighted residual factors for significantly intense reflections: 0.0859
• Weighted residual factors for all reflections included in the refinement: 0.0955
• Goodness-of-fit parameter for all reflections included in the refinement: 1.012
• Diffraction radiation wavelength: 0.41328 Å
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No