Information card for entry 2226690

Structure parameters

• Chemical name: (<i>E</i>)-1-[(2-Hydroxy-1-naphthyl)methylideneamino]imidazolidine-2,4-dione
• Formula: C14 H11 N3 O3
• Calculated formula: C14 H11 N3 O3
• SMILES: O=C1N(/N=C/c2c3c(cccc3)ccc2O)CC(=O)N1
• Title of publication: (<i>E</i>)-1-[(2-Hydroxy-1-naphthyl)methylideneamino]imidazolidine-2,4-dione
• Authors of publication: Sheng, Liang-Quan; Xu, Hua-Jie; Du, Na-Na; Jiang, Xue-Yue
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 7
• Pages of publication: o1601
• a: 11.5122 ± 0.0007 Å
• b: 6.0233 ± 0.0003 Å
• c: 17.9955 ± 0.001 Å
• α: 90°
• β: 96.773 ± 0.005°
• γ: 90°
• Cell volume: 1239.13 ± 0.12 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0953
• Residual factor for significantly intense reflections: 0.0357
• Weighted residual factors for significantly intense reflections: 0.0576
• Weighted residual factors for all reflections included in the refinement: 0.0668
• Goodness-of-fit parameter for all reflections included in the refinement: 0.718
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes