Information card for entry 7047999

Structure parameters

• Common name: 5-chloro-7-{[(2-fluorobenzyl)amino]methyl}quinolin-8-ol
• Formula: C17 H17 Cl2 F N2 O2
• Calculated formula: C17 H17 Cl2 F N2 O2
• Title of publication: Impact of copper and iron binding properties on the anticancer activity of 8-hydroxyquinoline derived Mannich bases.
• Authors of publication: Pape, Veronika F. S.; May, Nóra V; Gál, G Tamás; Szatmári, István; Szeri, Flóra; Fülöp, Ferenc; Szakács, Gergely; Enyedy, Éva A
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 47
• Pages of publication: 17032 - 17045
• a: 7.022 ± 0.0003 Å
• b: 9.497 ± 0.0005 Å
• c: 13.823 ± 0.0006 Å
• α: 95.43 ± 0.002°
• β: 101.79 ± 0.001°
• γ: 99.44 ± 0.002°
• Cell volume: 882.29 ± 0.07 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0452
• Residual factor for significantly intense reflections: 0.0385
• Weighted residual factors for significantly intense reflections: 0.1021
• Weighted residual factors for all reflections included in the refinement: 0.1078
• 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: No