Information card for entry 7134416

Structure parameters

• Chemical name: BDN 390
• Formula: C24 H15 N O2
• Calculated formula: C24 H15 N O2
• Title of publication: Rh-catalyzed [3+3]-annulation of quinolines with cyclopropenones: access to functionalized 2-quinolones
• Authors of publication: Debnath, Bijoy; Mandal, Santu; Saha, Sharajit; Karjee, Pallab; Punniyamurthy, Tharmalingam
• Journal of publication: Chemical Communications
• Year of publication: 2025
• Journal volume: 61
• Journal issue: 43
• Pages of publication: 7875 - 7878
• a: 9.3265 ± 0.0007 Å
• b: 16.1716 ± 0.0011 Å
• c: 11.842 ± 0.0008 Å
• α: 90°
• β: 92.342 ± 0.002°
• γ: 90°
• Cell volume: 1784.6 ± 0.2 ų
• Cell temperature: 297 ± 2 K
• Ambient diffraction temperature: 297 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0913
• Residual factor for significantly intense reflections: 0.0589
• Weighted residual factors for significantly intense reflections: 0.1293
• Weighted residual factors for all reflections included in the refinement: 0.1553
• Goodness-of-fit parameter for all reflections included in the refinement: 1.089
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No