Information card for entry 2007936

Structure parameters

• Common name: quinoline-4-carboxylic acid
• Formula: C10 H7 N O2
• Calculated formula: C10 H7 N O2
• SMILES: OC(=O)c1ccnc2c1cccc2
• Title of publication: Quinoline-4-carboxylic Acid
• Authors of publication: Dobson, Allison J.; Gerkin, Roger E.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1998
• Journal volume: 54
• Journal issue: 12
• Pages of publication: 1883 - 1885
• a: 7.6299 ± 0.0008 Å
• b: 7.5234 ± 0.0009 Å
• c: 13.6917 ± 0.0008 Å
• α: 90°
• β: 93.28 ± 0.007°
• γ: 90°
• Cell volume: 784.65 ± 0.13 ų
• Cell temperature: 296 K
• Ambient diffraction temperature: 296 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for significantly intense reflections: 0.036
• Weighted residual factors for significantly intense reflections: 0.085
• Goodness-of-fit parameter for significantly intense reflections: 1.86
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No