Information card for entry 4106262

Structure parameters

• Formula: C35 H46 O2 Si
• Calculated formula: C35 H46 O2 Si
• SMILES: [Si](O[C@@H]1C[C@]2(CC[C@H]([C@H]3C(=O)[C@@H]([C@H]4CC[C@@]1(C4=C23)C)C)C)C)(C(C)(C)C)(c1ccccc1)c1ccccc1.[Si](O[C@H]1C[C@@]2(CC[C@@H]([C@@H]3C(=O)[C@H]([C@@H]4CC[C@]1(C4=C23)C)C)C)C)(C(C)(C)C)(c1ccccc1)c1ccccc1
• Title of publication: A Concise, Stereocontrolled Total Synthesis of Rippertenol
• Authors of publication: Scott A. Snyder; Daniel A. Wespe; J. Marian von Hof
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2011
• Journal volume: 133
• Pages of publication: 8850 - 8853
• a: 8.2949 ± 0.0014 Å
• b: 10.2967 ± 0.0018 Å
• c: 18.515 ± 0.003 Å
• α: 78.3 ± 0.003°
• β: 83.853 ± 0.003°
• γ: 85.079 ± 0.003°
• Cell volume: 1536.3 ± 0.4 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 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: 0.2081
• Residual factor for significantly intense reflections: 0.051
• Weighted residual factors for significantly intense reflections: 0.0603
• Weighted residual factors for all reflections included in the refinement: 0.0874
• Goodness-of-fit parameter for all reflections included in the refinement: 0.682
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No