Information card for entry 4134576

Structure parameters

• Formula: C29 H27 Cl N2 O6 S
• Calculated formula: C29 H27 Cl N2 O6 S
• Title of publication: Hydroxylamines as Bifunctional Single-Nitrogen Sources for the Rapid Assembly of Diverse Tricyclic Indole Scaffolds.
• Authors of publication: Fan, Liangxin; Hao, Jiamao; Yu, Jingxun; Ma, Xiaojun; Liu, Jingjing; Luan, Xinjun
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2020
• a: 10.262 ± 0.002 Å
• b: 11.446 ± 0.003 Å
• c: 12.83 ± 0.003 Å
• α: 72.823 ± 0.004°
• β: 78.115 ± 0.004°
• γ: 75.963 ± 0.004°
• Cell volume: 1382 ± 0.6 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1177
• Residual factor for significantly intense reflections: 0.0683
• Weighted residual factors for significantly intense reflections: 0.1821
• Weighted residual factors for all reflections included in the refinement: 0.2242
• Goodness-of-fit parameter for all reflections included in the refinement: 1.053
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No