Information card for entry 1517512

Structure parameters

• Formula: C20 H32 O5 Si
• Calculated formula: C20 H32 O5 Si
• SMILES: [Si](O[C@@H]1C=C[C@@H]([C@@H]2C(=O)[C@@]3(OC)[C@@H](O)[C@@]12C(=O)[C@H]3C)C)(C)(C)C(C)(C)C.[Si](O[C@H]1C=C[C@H]([C@H]2C(=O)[C@]3(OC)[C@H](O)[C@]12C(=O)[C@@H]3C)C)(C)(C)C(C)(C)C
• Title of publication: A short access to the skeleton of elisabethin a and formal syntheses of elisapterosin B and colombiasin a.
• Authors of publication: Preindl, Johannes; Leitner, Christian; Baldauf, Simon; Mulzer, Johann
• Journal of publication: Organic letters
• Year of publication: 2014
• Journal volume: 16
• Journal issue: 16
• Pages of publication: 4276 - 4279
• a: 14.105 ± 0.0011 Å
• b: 24.9328 ± 0.0018 Å
• c: 25.654 ± 0.002 Å
• α: 90.9 ± 0.002°
• β: 102.396 ± 0.002°
• γ: 104.559 ± 0.002°
• Cell volume: 8505.5 ± 1.1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.1249
• Residual factor for significantly intense reflections: 0.0593
• Weighted residual factors for significantly intense reflections: 0.1095
• Weighted residual factors for all reflections included in the refinement: 0.1333
• Goodness-of-fit parameter for all reflections included in the refinement: 1.004
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No