Information card for entry 1544938

Structure parameters

• Formula: C32 H37 N3 O8 S
• Calculated formula: C32 H37 N3 O8 S
• Title of publication: Biomimetic Total Synthesis of the Pentacyclic Amaryllidaceae Alkaloid Derivative Gracilamine.
• Authors of publication: Gao, Nadia Yuqian; Banwell, Martin G.; Willis, Anthony C.
• Journal of publication: Organic letters
• Year of publication: 2017
• Journal volume: 19
• Journal issue: 1
• Pages of publication: 162 - 165
• a: 8.89 ± 0.0002 Å
• b: 31.1842 ± 0.0007 Å
• c: 11.2873 ± 0.0003 Å
• α: 90°
• β: 90.258 ± 0.001°
• γ: 90°
• Cell volume: 3129.12 ± 0.13 ų
• Cell temperature: 200 K
• Ambient diffraction temperature: 200 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0878
• Residual factor for significantly intense reflections: 0.0523
• Weighted residual factors for all reflections: 0.1334
• Weighted residual factors for significantly intense reflections: 0.1173
• Weighted residual factors for all reflections included in the refinement: 0.1334
• Goodness-of-fit parameter for all reflections included in the refinement: 0.9883
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No