Information card for entry 4128146

Structure parameters

• Formula: C18 H19 Cl N2 O
• Calculated formula: C18 H19 Cl N2 O
• Title of publication: Enantioselective Total Synthesis of (+)-Arboridinine.
• Authors of publication: Zhang, Zhen; Xie, Sujun; Cheng, Bin; Zhai, Hongbin; Li, Yun
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2019
• Journal volume: 141
• Journal issue: 17
• Pages of publication: 7147 - 7154
• a: 33.295 ± 0.003 Å
• b: 11.0183 ± 0.0007 Å
• c: 12.8497 ± 0.0008 Å
• α: 90°
• β: 99.527 ± 0.007°
• γ: 90°
• Cell volume: 4649 ± 0.6 ų
• Cell temperature: 294.1 ± 0.7 K
• Ambient diffraction temperature: 294.1 ± 0.7 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: 0.1704
• Residual factor for significantly intense reflections: 0.0792
• Weighted residual factors for significantly intense reflections: 0.1619
• Weighted residual factors for all reflections included in the refinement: 0.2178
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No