Information card for entry 2236261

Structure parameters

• Chemical name: 2,2-Diphenyl-<i>N</i>-(2,4,5-trichlorophenyl)acetamide
• Formula: C20 H14 Cl3 N O
• Calculated formula: C20 H14 Cl3 N O
• SMILES: Clc1c(NC(=O)C(c2ccccc2)c2ccccc2)cc(Cl)c(Cl)c1
• Title of publication: 2,2-Diphenyl-<i>N</i>-(2,4,5-trichlorophenyl)acetamide
• Authors of publication: Fun, Hoong-Kun; Quah, Ching Kheng; Nayak, Prakash S.; Narayana, B.; Sarojini, B. K.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 9
• Pages of publication: o2659 - o2660
• a: 18.663 ± 0.0016 Å
• b: 17.1713 ± 0.0015 Å
• c: 22.5648 ± 0.0019 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 7231.3 ± 1.1 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0808
• Residual factor for significantly intense reflections: 0.0467
• Weighted residual factors for significantly intense reflections: 0.0992
• Weighted residual factors for all reflections included in the refinement: 0.1136
• Goodness-of-fit parameter for all reflections included in the refinement: 1.018
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes