Information card for entry 7160895

Structure parameters

• Formula: C19 H14 Cl N O3
• Calculated formula: C19 H14 Cl N O3
• Title of publication: Ruthenium-Catalyzed Late-Stage C–H Alkenylation of N-arylpyridazino[4,5-b] quinolin-1(2H)-ones
• Authors of publication: Kameshwaran, Chinnagounder; Nawaz Khan, Fazlur-Rahman
• Journal of publication: Organic & Biomolecular Chemistry
• Year of publication: 2025
• a: 12.782 ± 0.019 Å
• b: 15.878 ± 0.018 Å
• c: 8.643 ± 0.011 Å
• α: 90°
• β: 93.91 ± 0.05°
• γ: 90°
• Cell volume: 1750 ± 4 ų
• Cell temperature: 300 ± 2 K
• Ambient diffraction temperature: 300 ± 2 K
• Number of distinct elements: 5
• 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: 0.1347
• Residual factor for significantly intense reflections: 0.066
• Weighted residual factors for significantly intense reflections: 0.1623
• Weighted residual factors for all reflections included in the refinement: 0.2068
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No