Information card for entry 2232508

Structure parameters

• Common name: 6-(3,5-dimethylbenzyl)-5-ethyl-1-(phenoxyethoxymethyl)uracil
• Chemical name: 6-(3,5-Dimethylbenzyl)-5-ethyl-1-[(2-phenoxyethoxy)methyl]-1,2,3,4- tetrahydropyrimidine-2,4-dione
• Formula: C24 H28 N2 O4
• Calculated formula: C24 H28 N2 O4
• Title of publication: 6-(3,5-Dimethylbenzyl)-5-ethyl-1-[(2-phenoxyethoxy)methyl]-1,2,3,4-tetrahydropyrimidine-2,4-dione
• Authors of publication: El-Brollosy, Nasser R.; El-Emam, Ali A.; Al-Deeb, Omar A.; Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 11
• Pages of publication: o2839
• a: 16.1116 ± 0.0006 Å
• b: 4.8211 ± 0.0002 Å
• c: 27.5125 ± 0.001 Å
• α: 90°
• β: 92.574 ± 0.003°
• γ: 90°
• Cell volume: 2134.89 ± 0.14 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0754
• Residual factor for significantly intense reflections: 0.048
• Weighted residual factors for significantly intense reflections: 0.1104
• Weighted residual factors for all reflections included in the refinement: 0.1298
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes