Information card for entry 2210230

Structure parameters

• Chemical name: Methyl 5-(2-hydr­oxyethyl­carbamo­yl)-2,6-dimethyl-4-(3-nitrophen­yl)-1,4-dihydropyridine-3-carboxylate
• Formula: C18 H21 N3 O6
• Calculated formula: C18 H21 N3 O6
• Title of publication: Methyl 5-[<i>N</i>-(2-hydroxyethyl)carbamoyl]-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate
• Authors of publication: Sun, Feng-Xia; Ha, Jing; Fu, De-Cai; Yu, Yi-Feng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 9
• Pages of publication: o4112 - o4114
• a: 14.1028 ± 0.0015 Å
• b: 14.4948 ± 0.0016 Å
• c: 8.6701 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1772.3 ± 0.3 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 113 ± 2 K
• Number of distinct elements: 4
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0413
• Residual factor for significantly intense reflections: 0.0381
• Weighted residual factors for significantly intense reflections: 0.0995
• Weighted residual factors for all reflections included in the refinement: 0.1017
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes