Information card for entry 2313045

Structure parameters

• Chemical name: (<i>RS</i>)-6-Hydroxy-6-(2-oxopropyl)-1,10-phenanthrolin-5(6<i>H</i>)-one
• Formula: C15 H12 N2 O3
• Calculated formula: C15 H12 N2 O3
• Title of publication: Synthesis and structure of (<i>RS</i>)-6-hy-droxy-6-(2-oxoprop-yl)-1,10-phenanthrolin-5(6<i>H</i>)-one.
• Authors of publication: Benlatreche, Tarek; Mezrag, Abderrahmane; Boualia, Boutheina; Golhen, Stéphane
• Journal of publication: Acta crystallographica. Section E, Crystallographic communications
• Year of publication: 2026
• Journal volume: 82
• Journal issue: Pt 6
• Pages of publication: 578 - 582
• a: 11.244 ± 0.0019 Å
• b: 12.604 ± 0.002 Å
• c: 8.9926 ± 0.0014 Å
• α: 90°
• β: 106.87 ± 0.006°
• γ: 90°
• Cell volume: 1219.6 ± 0.3 ų
• Cell temperature: 150.15 K
• Ambient diffraction temperature: 150.15 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 all reflections: 0.0676
• Residual factor for significantly intense reflections: 0.0518
• Weighted residual factors for significantly intense reflections: 0.1226
• Weighted residual factors for all reflections included in the refinement: 0.1318
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No