Information card for entry 2216722

Structure parameters

• Chemical name: N-(3-Diacetylamino-2-methoxy-5-methylphenyl)acetamide
• Formula: C14 H18 N2 O4
• Calculated formula: C14 H18 N2 O4
• SMILES: c1(c(cc(cc1N(C(=O)C)C(=O)C)C)NC(=O)C)OC
• Title of publication: <i>N</i>-(3-Diacetylamino-2-methoxy-5-methylphenyl)acetamide
• Authors of publication: Polson, Matthew I. J.; Steel, Peter J.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 12
• Pages of publication: o4796 - o4796
• a: 7.2781 ± 0.0002 Å
• b: 9.5338 ± 0.0002 Å
• c: 20.4017 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1415.63 ± 0.06 ų
• Cell temperature: 93 ± 2 K
• Ambient diffraction temperature: 93 ± 2 K
• Number of distinct elements: 4
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0264
• Residual factor for significantly intense reflections: 0.0241
• Weighted residual factors for significantly intense reflections: 0.0613
• Weighted residual factors for all reflections included in the refinement: 0.063
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes