Information card for entry 4023691

Structure parameters

• Formula: C23 H34 N2 O7
• Calculated formula: C23 H34 N2 O7
• Title of publication: Synthesis of Carbapyochelins via Diastereoselective Azidation of 5-(Ethoxycarbonyl)methylproline Derivatives
• Authors of publication: Wathsala Liyanage; Laksiri Weerasinghe; Roland K. Strong; Juan R. Del Valle
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2008
• Journal volume: 73
• Pages of publication: 7420 - 7423
• a: 9.0823 ± 0.0006 Å
• b: 9.2605 ± 0.0007 Å
• c: 29.233 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2458.7 ± 0.3 ų
• Cell temperature: 228 ± 2 K
• Ambient diffraction temperature: 228 ± 2 K
• Number of distinct elements: 4
• 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: 0.0496
• Residual factor for significantly intense reflections: 0.0397
• Weighted residual factors for significantly intense reflections: 0.1024
• Weighted residual factors for all reflections included in the refinement: 0.1106
• 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: Yes
• Has Fobs: No