Information card for entry 7160597

Structure parameters

• Formula: C24 H18 Cl3 N3 O2
• Calculated formula: C24 H18 Cl3 N3 O2
• Title of publication: Convergent synthesis of coumarin C3-C4-fused fluorogenic quinoline scaffolds <i>via</i> aldehyde activation using <i>in situ</i> generated hydrazoic acid.
• Authors of publication: Ganesan, Ranjithkumar; Kamaraj, Sriraghavan
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2025
• Journal volume: 23
• Journal issue: 27
• Pages of publication: 6564 - 6569
• a: 8.815 ± 0.002 Å
• b: 9.048 ± 0.003 Å
• c: 14.657 ± 0.003 Å
• α: 77.286 ± 0.01°
• β: 85.08 ± 0.02°
• γ: 75.836 ± 0.016°
• Cell volume: 1105.1 ± 0.5 ų
• Cell temperature: 300 ± 2 K
• Ambient diffraction temperature: 300 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1694
• Residual factor for significantly intense reflections: 0.1006
• Weighted residual factors for significantly intense reflections: 0.1907
• Weighted residual factors for all reflections included in the refinement: 0.225
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No