Information card for entry 2008927

Structure parameters

• Formula: C15 H11 Cl2 N O
• Calculated formula: C15 H11 Cl2 N O
• SMILES: ClC1(Cl)C(=O)N(c2ccccc2)C1c1ccccc1
• Title of publication: 3,3-Dichloro-1,4-diphenylazetidin-2-one
• Authors of publication: Kabak, Mehmet; Elerman, Yalc̨in; Güner, Vildan; Yildirir, Süleyman; Durlu, Tahsin Nuri
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1999
• Journal volume: 55
• Journal issue: 9
• Pages of publication: 1511 - 1512
• a: 19.305 ± 0.002 Å
• b: 5.958 ± 0.001 Å
• c: 23.847 ± 0.002 Å
• α: 90°
• β: 91.989 ± 0.008°
• γ: 90°
• Cell volume: 2741.2 ± 0.6 ų
• Cell temperature: 293.2 K
• Ambient diffraction temperature: 293.2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.057
• Residual factor for significantly intense reflections: 0.057
• Weighted residual factors for all reflections: 0.057
• Weighted residual factors for all reflections included in the refinement: 0.057
• Goodness-of-fit parameter for all reflections: 0.949
• Goodness-of-fit parameter for all reflections included in the refinement: 0.95
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No