Information card for entry 1546192

Structure parameters

• Formula: C19 H26 N2
• Calculated formula: C19 H26 N2
• SMILES: c12ccccc1[C@]13CCN4CCC[C@](CC[C@H]1N2)([C@H]34)CC
• Title of publication: Divergent Asymmetric Total Synthesis of (+)-Vincadifformine, (-)-Quebrachamine, (+)-Aspidospermidine, (-)-Aspidospermine, (-)-Pyrifolidine, and Related Natural Products.
• Authors of publication: Wang, Nengzhong; Du, Shuo; Li, Dong; Jiang, Xuefeng
• Journal of publication: Organic letters
• Year of publication: 2017
• Journal volume: 19
• Journal issue: 12
• Pages of publication: 3167 - 3170
• a: 11.1357 ± 0.0016 Å
• b: 12.5468 ± 0.0019 Å
• c: 22.93 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3203.7 ± 0.8 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 3
• 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: 0.1259
• Residual factor for significantly intense reflections: 0.0769
• Weighted residual factors for significantly intense reflections: 0.1942
• Weighted residual factors for all reflections included in the refinement: 0.233
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No