Information card for entry 2216766

Structure parameters

• Chemical name: 2-(5,7-Dibromoquinolin-8-yloxy)-<i>N</i>,<i>N</i>-diphenylacetamide
• Formula: C23 H16 Br2 N2 O2
• Calculated formula: C23 H16 Br2 N2 O2
• SMILES: Brc1c(OCC(=O)N(c2ccccc2)c2ccccc2)c2c(c(Br)c1)cccn2
• Title of publication: 2-(5,7-Dibromoquinolin-8-yloxy)-<i>N</i>,<i>N</i>-diphenylacetamide
• Authors of publication: Sai Bi; Xiao-Hui Wu; Xiao-Fang Tang; Yong-Hong Wen
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 12
• Pages of publication: o4521 - o4521
• a: 10.1223 ± 0.0012 Å
• b: 9.6013 ± 0.0011 Å
• c: 21.003 ± 0.003 Å
• α: 90°
• β: 93.826 ± 0.002°
• γ: 90°
• Cell volume: 2036.7 ± 0.4 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: 0.0976
• Residual factor for significantly intense reflections: 0.0499
• Weighted residual factors for significantly intense reflections: 0.093
• Weighted residual factors for all reflections included in the refinement: 0.1103
• Goodness-of-fit parameter for all reflections included in the refinement: 0.962
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes