Information card for entry 7150936

Structure parameters

• Formula: C20 H24 O2 Si
• Calculated formula: C20 H24 O2 Si
• SMILES: [Si]1(O[C@@H](C[C@@H](O1)C)[C@H](C=C)C)(c1ccccc1)c1ccccc1.[Si]1(O[C@H](C[C@H](O1)C)[C@@H](C=C)C)(c1ccccc1)c1ccccc1
• Title of publication: Further studies on silatropic carbonyl ene cyclisations: β-crotyl(diphenyl)silyloxy aldehyde substrates; synthesis of 2-deoxy-2-C-phenylhexoses
• Authors of publication: Robertson, Jeremy; Green, Stuart P.; Hall, Michael J.; Tyrrell, Andrew J.; Unsworth, William P.
• Journal of publication: Organic & Biomolecular Chemistry
• Year of publication: 2008
• Journal volume: 6
• Journal issue: 14
• Pages of publication: 2628 - 2635
• a: 8.8918 ± 0.0003 Å
• b: 15.1623 ± 0.0007 Å
• c: 13.7021 ± 0.0005 Å
• α: 90°
• β: 97.145 ± 0.003°
• γ: 90°
• Cell volume: 1832.97 ± 0.12 ų
• Cell temperature: 120 K
• Ambient diffraction temperature: 120 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for significantly intense reflections: 0.0515
• Weighted residual factors for all reflections included in the refinement: 0.0584
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0328
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No