Information card for entry 1505869

Structure parameters

• Common name: 05294
• Formula: C36 H45 N O4 Si
• Calculated formula: C36 H45 N O4 Si
• SMILES: [Si](OC[C@@H]1N2[C@@]3([C@H](C(=O)[C@@H]4C(=O)O[C@H](C=C24)CCCC)CCCC3)CC1)(C(C)(C)C)(c1ccccc1)c1ccccc1
• Title of publication: A concise total synthesis of (-)-cylindricine C through a stereoselective intramolecular aza-[3 + 3] annulation strategy.
• Authors of publication: Swidorski, Jacob J.; Wang, Jiashi; Hsung, Richard P.
• Journal of publication: Organic letters
• Year of publication: 2006
• Journal volume: 8
• Journal issue: 4
• Pages of publication: 777 - 780
• a: 8.3022 ± 0.0007 Å
• b: 14.6332 ± 0.0012 Å
• c: 26.376 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3204.4 ± 0.4 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0694
• Residual factor for significantly intense reflections: 0.0399
• Weighted residual factors for significantly intense reflections: 0.0831
• Weighted residual factors for all reflections included in the refinement: 0.0971
• Goodness-of-fit parameter for all reflections included in the refinement: 1.017
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No