Information card for entry 1519174

Structure parameters

• Formula: C18 H19 N O2
• Calculated formula: C18 H19 N O2
• SMILES: O=C(N(CC(C)C)C(=O)c1ccccc1)c1ccccc1
• Title of publication: C18H19NO2
• Authors of publication: Tebby, John C.; Hibbs, Dai E.; Hursthouse, Michael B.; Lamond, Steven J.
• Journal of publication: Crystal Structure Report Archive
• Year of publication: 1996
• Pages of publication: 796
• a: 7.93 ± 0.001 Å
• b: 8.717 ± 0.0006 Å
• c: 11.655 ± 0.001 Å
• α: 75.19 ± 0.008°
• β: 78.74 ± 0.009°
• γ: 89.93 ± 0.007°
• Cell volume: 762.9 ± 0.13 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.0617
• Residual factor for significantly intense reflections: 0.0422
• Weighted residual factors for significantly intense reflections: 0.0953
• Weighted residual factors for all reflections included in the refinement: 0.1014
• Goodness-of-fit parameter for all reflections included in the refinement: 0.909
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No