Information card for entry 1555741

Structure parameters

• Formula: C15 H23 N O3
• Calculated formula: C15 H23 N O3
• SMILES: O=C1N2[C@]34[C@H](CC1)[C@H]([C@H](O)[C@H](O)[C@@H]3CC2)C[C@H](C4)C
• Title of publication: Asymmetric Total Synthesis of (-)-Lycospidine A.
• Authors of publication: Xu, Shiyan; Zhang, Jing; Ma, Donghui; Xu, Dengyu; Xie, Xingang; She, Xuegong
• Journal of publication: Organic letters
• Year of publication: 2016
• Journal volume: 18
• Journal issue: 18
• Pages of publication: 4682 - 4685
• a: 8.5731 ± 0.0005 Å
• b: 9.2969 ± 0.0004 Å
• c: 17.1079 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1363.56 ± 0.11 ų
• Cell temperature: 294.23 ± 0.1 K
• Ambient diffraction temperature: 294.23 ± 0.1 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: 0.0722
• Residual factor for significantly intense reflections: 0.0532
• Weighted residual factors for significantly intense reflections: 0.0978
• Weighted residual factors for all reflections included in the refinement: 0.1118
• Goodness-of-fit parameter for all reflections included in the refinement: 1.089
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No