Information card for entry 2221093

Structure parameters

• Chemical name: <i>N</i>-Cyclopentyl-3-(4-hydroxy-6-oxo-1,6-dihydropyrimidin-5-yl)- 3-<i>p</i>-tolylpropanamide
• Formula: C19 H23 N3 O3
• Calculated formula: C19 H23 N3 O3
• Title of publication: <i>N</i>-Cyclopentyl-3-(4-hydroxy-6-oxo-1,6-dihydropyrimidin-5-yl)-3-<i>p</i>-tolylpropanamide
• Authors of publication: Wang, Xing-Han; Hao, Wen-Juan; Tu, Shu-Jiang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 3
• Pages of publication: o488
• a: 11.6798 ± 0.001 Å
• b: 14.8279 ± 0.0016 Å
• c: 11.8422 ± 0.0012 Å
• α: 90°
• β: 115.022 ± 0.002°
• γ: 90°
• Cell volume: 1858.4 ± 0.3 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 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: 0.0897
• Residual factor for significantly intense reflections: 0.0413
• Weighted residual factors for significantly intense reflections: 0.099
• Weighted residual factors for all reflections included in the refinement: 0.13
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes