Information card for entry 4134575

Structure parameters

• Formula: C27 H23 I N2 Pd
• Calculated formula: C27 H23 I N2 Pd
• 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: 10.4805 ± 0.0019 Å
• b: 14.527 ± 0.003 Å
• c: 15.293 ± 0.003 Å
• α: 90°
• β: 100.045 ± 0.003°
• γ: 90°
• Cell volume: 2292.7 ± 0.8 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0338
• Residual factor for significantly intense reflections: 0.0262
• Weighted residual factors for significantly intense reflections: 0.0621
• Weighted residual factors for all reflections included in the refinement: 0.0659
• Goodness-of-fit parameter for all reflections included in the refinement: 1.087
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No