Information card for entry 2214750

Structure parameters

• Chemical name: 2,2-Dimethyl-<i>N</i>-(2,4,6-trichlorophenyl)acetamide
• Formula: C10 H10 Cl3 N O
• Calculated formula: C10 H10 Cl3 N O
• SMILES: c1(c(cc(cc1Cl)Cl)Cl)NC(=O)C(C)C
• Title of publication: 2,2-Dimethyl-<i>N</i>-(2,4,6-trichlorophenyl)acetamide
• Authors of publication: B. Thimme Gowda; Ingrid Svoboda; Hartmut Fuess
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 8
• Pages of publication: o3366 - o3366
• a: 4.731 ± 0.0006 Å
• b: 24.042 ± 0.002 Å
• c: 10.799 ± 0.001 Å
• α: 90°
• β: 98.01 ± 0.01°
• γ: 90°
• Cell volume: 1216.3 ± 0.2 ų
• Cell temperature: 297 ± 2 K
• Ambient diffraction temperature: 297 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1082
• Residual factor for significantly intense reflections: 0.0596
• Weighted residual factors for significantly intense reflections: 0.1056
• Weighted residual factors for all reflections included in the refinement: 0.1258
• Goodness-of-fit parameter for all reflections included in the refinement: 1.083
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes