Information card for entry 2239032

Structure parameters

• Chemical name: 7-Methoxy-2-phenylquinoline-3-carbaldehyde
• Formula: C17 H13 N O2
• Calculated formula: C17 H13 N O2
• SMILES: O=Cc1cc2ccc(cc2nc1c1ccccc1)OC
• Title of publication: 7-Methoxy-2-phenylquinoline-3-carbaldehyde
• Authors of publication: Hayour, Hasna; Bouraiou, Abdelmalek; Bouacida, Sofiane; Benzerka, Saida; Belfaitah, Ali
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2014
• Journal volume: 70
• Journal issue: 2
• Pages of publication: o195 - o196
• a: 7.332 ± 0.003 Å
• b: 7.582 ± 0.002 Å
• c: 12.487 ± 0.004 Å
• α: 73.424 ± 0.012°
• β: 85.877 ± 0.012°
• γ: 83.029 ± 0.011°
• Cell volume: 659.9 ± 0.4 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0618
• Residual factor for significantly intense reflections: 0.0482
• Weighted residual factors for significantly intense reflections: 0.1268
• Weighted residual factors for all reflections included in the refinement: 0.1383
• Goodness-of-fit parameter for all reflections included in the refinement: 1.062
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes