Information card for entry 2005615

Structure parameters

• Formula: C17 H13 F N2 O2
• Calculated formula: C17 H13 F N2 O2
• Title of publication: 3-Benzyl-5-(2-fluorobenzylidene)imidazolidine-2,4-dione
• Authors of publication: De Simone, C. A.; Pereira, M. A.; Luu-Duc, C.; Pitta, I. R.; Galdino, S. L.; Menezes, E. H. C.; Zukerman-Schpector, J.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1996
• Journal volume: 52
• Journal issue: 11
• Pages of publication: 2771 - 2772
• a: 13.102 ± 0.002 Å
• b: 7.077 ± 0.002 Å
• c: 16.233 ± 0.002 Å
• α: 90°
• β: 109.31 ± 0.02°
• γ: 90°
• Cell volume: 1420.5 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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: 0.0845
• Residual factor for significantly intense reflections: 0.0562
• Weighted residual factors for all reflections: 0.1689
• Weighted residual factors for significantly intense reflections: 0.1387
• Goodness-of-fit parameter for all reflections: 1.114
• Goodness-of-fit parameter for significantly intense reflections: 1.11
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No