Information card for entry 2228390

Structure parameters

• Chemical name: 2-[(5,7-Dibromoquinolin-8-yl)oxy]-<i>N</i>-(2-methoxyphenyl)acetamide
• Formula: C18 H14 Br2 N2 O3
• Calculated formula: C18 H14 Br2 N2 O3
• SMILES: Brc1cc(Br)c2cccnc2c1OCC(=O)Nc1ccccc1OC
• Title of publication: 2-[(5,7-Dibromoquinolin-8-yl)oxy]-<i>N</i>-(2-methoxyphenyl)acetamide
• Authors of publication: Wen, Yong-Hong; Qin, Hong-Qing; Wen, Hui-Ling
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 12
• Pages of publication: o3294
• a: 8.757 ± 0.0018 Å
• b: 8.7279 ± 0.0017 Å
• c: 22.372 ± 0.005 Å
• α: 90°
• β: 98.04 ± 0.03°
• γ: 90°
• Cell volume: 1693.1 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0568
• Residual factor for significantly intense reflections: 0.0438
• Weighted residual factors for significantly intense reflections: 0.0863
• Weighted residual factors for all reflections included in the refinement: 0.0927
• Goodness-of-fit parameter for all reflections included in the refinement: 1.063
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes