Information card for entry 2210172

Structure parameters

• Chemical name: 7-(4-fluorophenyl)-8H-benzo[h]indeno[1,2-b]quinolin-8-one
• Formula: C26 H14 F N O
• Calculated formula: C26 H14 F N O
• SMILES: Fc1ccc(c2c3c(nc4c2ccc2ccccc42)c2ccccc2C3=O)cc1
• Title of publication: 7-(4-Fluorophenyl)-8<i>H</i>-benzo[<i>h</i>]indeno[1,2-<i>b</i>]quinolin-8-one
• Authors of publication: Shu-Jiang Tu; Yan Zhang; Run-Hong Jia
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 9
• Pages of publication: o3928 - o3929
• a: 10.971 ± 0.004 Å
• b: 6.274 ± 0.002 Å
• c: 13.54 ± 0.004 Å
• α: 90°
• β: 103.115 ± 0.005°
• γ: 90°
• Cell volume: 907.7 ± 0.5 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0783
• Residual factor for significantly intense reflections: 0.0387
• Weighted residual factors for significantly intense reflections: 0.075
• Weighted residual factors for all reflections included in the refinement: 0.0894
• Goodness-of-fit parameter for all reflections included in the refinement: 0.997
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes