Information card for entry 2221447

Structure parameters

• Chemical name: 1-(4-Chlorophenylsulfonyl)-5-(4-fluorophenyl)-5-methylimidazolidine-2,4-dione
• Formula: C16 H12 Cl F N2 O4 S
• Calculated formula: C16 H12 Cl F N2 O4 S
• SMILES: Fc1ccc(cc1)C1(C)C(=O)NC(=O)N1S(=O)(=O)c1ccc(cc1)Cl
• Title of publication: 1-(4-Chlorophenylsulfonyl)-5-(4-fluorophenyl)-5-methylimidazolidine-2,4-dione
• Authors of publication: Hussain, Abid; Hameed, Shahid; Stoeckli-Evans, Helen
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 4
• Pages of publication: o858 - o859
• a: 9.6959 ± 0.0007 Å
• b: 10.0066 ± 0.0007 Å
• c: 16.6269 ± 0.0013 Å
• α: 92.098 ± 0.006°
• β: 93.63 ± 0.006°
• γ: 103.056 ± 0.006°
• Cell volume: 1566.2 ± 0.2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0586
• Residual factor for significantly intense reflections: 0.0373
• Weighted residual factors for significantly intense reflections: 0.0903
• Weighted residual factors for all reflections included in the refinement: 0.0953
• Goodness-of-fit parameter for all reflections included in the refinement: 0.893
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes