Information card for entry 2239400

Structure parameters

• Chemical name: 2,2-Dimethyl-<i>N</i>-(4-methylpyridin-2-yl)propanamide
• Formula: C11 H16 N2 O
• Calculated formula: C11 H16 N2 O
• SMILES: Cc1ccnc(c1)NC(=O)C(C)(C)C
• Title of publication: 2,2-Dimethyl-<i>N</i>-(4-methylpyridin-2-yl)propanamide
• Authors of publication: El-Hiti, Gamal A.; Smith, Keith; Balakit, Asim A.; Hegazy, Amany S.; Kariuki, Benson M.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2014
• Journal volume: 70
• Journal issue: 3
• Pages of publication: o351 - o352
• a: 10.7954 ± 0.0003 Å
• b: 10.1809 ± 0.0002 Å
• c: 20.839 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2290.35 ± 0.1 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• 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: 0.0599
• Residual factor for significantly intense reflections: 0.046
• Weighted residual factors for significantly intense reflections: 0.1445
• Weighted residual factors for all reflections included in the refinement: 0.1539
• Goodness-of-fit parameter for all reflections included in the refinement: 1.083
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes