Information card for entry 7158788

Structure parameters

• Formula: C19 H19 N O
• Calculated formula: C19 H19 N O
• Title of publication: Synthesis of N-alkoxy amines and hydroxylamines via the iridium-catalyzed transfer hydrogenation of oximes
• Authors of publication: Xia, Yanping; Wang, Sen; Miao, Rui; Liao, Jianhua; Ouyang, Lu; Luo, Renshi
• Journal of publication: Organic & Biomolecular Chemistry
• Year of publication: 2022
• a: 5.7379 ± 0.0003 Å
• b: 8.2844 ± 0.0005 Å
• c: 31.6487 ± 0.0019 Å
• α: 90°
• β: 91.477 ± 0.006°
• γ: 90°
• Cell volume: 1503.92 ± 0.15 ų
• Cell temperature: 149.99 ± 0.1 K
• Ambient diffraction temperature: 149.99 ± 0.1 K
• Number of distinct elements: 4
• 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: 0.0784
• Residual factor for significantly intense reflections: 0.0642
• Weighted residual factors for significantly intense reflections: 0.1686
• Weighted residual factors for all reflections included in the refinement: 0.1769
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No