Information card for entry 7160765

Structure parameters

• Chemical name: 7-methoxybenzo[h]quinoline
• Formula: C14 H11 N O
• Calculated formula: C14 H11 N O
• Title of publication: Donor acceptor phenanthrenes and benzoquinolines: synthesis by C-H activation and their photophysical properties.
• Authors of publication: Khandare, Sopan Pralhad; Mandal, Arnab; Patra, Abhijit; Bates, Roderick W.
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2025
• Journal volume: 23
• Journal issue: 41
• Pages of publication: 9424 - 9429
• a: 6.8333 ± 0.0004 Å
• b: 10.9215 ± 0.0007 Å
• c: 27.6222 ± 0.0018 Å
• α: 90°
• β: 96.331 ± 0.003°
• γ: 90°
• Cell volume: 2048.9 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0991
• Residual factor for significantly intense reflections: 0.0818
• Weighted residual factors for significantly intense reflections: 0.2324
• Weighted residual factors for all reflections included in the refinement: 0.2521
• Goodness-of-fit parameter for all reflections included in the refinement: 1.058
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No