Information card for entry 2207255

Structure parameters

• Formula: C21 H17 N O
• Calculated formula: C21 H17 N O
• SMILES: O=C1N([C@@H]([C@@H]1c1ccccc1)c1ccccc1)c1ccccc1.O=C1N([C@H]([C@H]1c1ccccc1)c1ccccc1)c1ccccc1
• Title of publication: (3<i>S</i>*,4<i>S</i>*)-1,3,4-Triphenylazetidin-2-one
• Authors of publication: Luo, Cheng-Cai; Zhang, Hua-Xing; Wu, Tian-Xing
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 11
• Pages of publication: o3956 - o3957
• a: 9.016 ± 0.003 Å
• b: 8.752 ± 0.003 Å
• c: 20.664 ± 0.008 Å
• α: 90°
• β: 100.614 ± 0.014°
• γ: 90°
• Cell volume: 1602.7 ± 1 ų
• Cell temperature: 296 ± 1 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 significantly intense reflections: 0.0364
• Weighted residual factors for all reflections included in the refinement: 0.0773
• Goodness-of-fit parameter for all reflections included in the refinement: 1
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes