Information card for entry 7108190

Structure parameters

• Formula: C20 H36 O3 Si
• Calculated formula: C20 H36 O3 Si
• SMILES: [Si](O[C@H]1C=C[C@@]2([C@H]([C@@](O)([C@]1([C@@H]2C=C)C)C)CO)C)(C)(C)C(C)(C)C
• Title of publication: Total synthesis of (+/-)-pallambins C and D
• Authors of publication: Xue-Song Xu; Zhen-Wu Li; Yi-Jun Zhang; Xiao-Shui Peng; Henry N. C. Wong
• Journal of publication: Chem.Commun.
• Year of publication: 2012
• Journal volume: 48
• Pages of publication: 8517
• a: 11.6292 ± 0.0015 Å
• b: 7.7435 ± 0.0011 Å
• c: 12.2967 ± 0.0016 Å
• α: 90°
• β: 90.516 ± 0.003°
• γ: 90°
• Cell volume: 1107.3 ± 0.3 ų
• Cell temperature: 243 ± 2 K
• Ambient diffraction temperature: 243 ± 2 K
• Number of distinct elements: 4
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0502
• Residual factor for significantly intense reflections: 0.0449
• Weighted residual factors for significantly intense reflections: 0.1185
• Weighted residual factors for all reflections included in the refinement: 0.1233
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No