Information card for entry 7133072

Structure parameters

• Formula: C19 H20 N2 O4
• Calculated formula: C19 H20 N2 O4
• Title of publication: Aminoarylation of Alkynes using Diarylanilines
• Authors of publication: Greaney, Michael; Liu, Zi
• Journal of publication: Chemical Communications
• Year of publication: 2024
• a: 8.1324 ± 0.0003 Å
• b: 11.0134 ± 0.0005 Å
• c: 20.24 ± 0.0008 Å
• α: 77.534 ± 0.004°
• β: 79.396 ± 0.004°
• γ: 80.934 ± 0.004°
• Cell volume: 1726.67 ± 0.13 ų
• Cell temperature: 99.7 ± 0.7 K
• Ambient diffraction temperature: 99.7 ± 0.7 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: 0.0723
• Residual factor for significantly intense reflections: 0.0514
• Weighted residual factors for significantly intense reflections: 0.1119
• Weighted residual factors for all reflections included in the refinement: 0.1232
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No