Information card for entry 2001828

Structure parameters

• Formula: C11 H12 N2 O2
• Calculated formula: C11 H12 N2 O2
• SMILES: CC[C@]1(NC(=O)NC1=O)c1ccccc1
• Title of publication: Structure of (+)-(<i>S</i>)-5-phenyl-5-ethylhydantoin
• Authors of publication: Coquerel, G.; Petit, M. N.; Robert, F.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1993
• Journal volume: 49
• Journal issue: 4
• Pages of publication: 824 - 825
• a: 6.23 Å
• b: 10.701 Å
• c: 15.55 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1036.68 ų
• Cell temperature: 293 ± 1 K
• Number of distinct elements: 4
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for significantly intense reflections: 0.037
• Weighted residual factors for significantly intense reflections: 0.039
• Goodness-of-fit parameter for significantly intense reflections: 2.36
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No