Information card for entry 1529853

Structure parameters

• Formula: C17 H19 N O3
• Calculated formula: C17 H19 N O3
• Title of publication: Chemoselective Carbene insertion into the N-H Bond over O-H Bond Using a Well-Defined Single Site (P-P)Cu(I) Catalyst.
• Authors of publication: Ramakrishna, Kankanala; Murali, Mani; Sivasankar, Chinnappan
• Journal of publication: Organic letters
• Year of publication: 2015
• Journal volume: 17
• Journal issue: 15
• Pages of publication: 3814 - 3817
• a: 5.7487 ± 0.0005 Å
• b: 9.5873 ± 0.0008 Å
• c: 13.7161 ± 0.0011 Å
• α: 85.932 ± 0.007°
• β: 86.522 ± 0.007°
• γ: 90.042 ± 0.007°
• Cell volume: 752.65 ± 0.11 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1299
• Residual factor for significantly intense reflections: 0.0635
• Weighted residual factors for significantly intense reflections: 0.1427
• Weighted residual factors for all reflections included in the refinement: 0.178
• 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: No
• Has Fobs: No