Information card for entry 7061630

Structure parameters

• Formula: C23 H17 N O2
• Calculated formula: C23 H17 N O2
• SMILES: O=C(OC)c1cc(nc2c1cc(cc2)c1ccccc1)c1ccccc1
• Title of publication: Functionalized D/A–A–D quinolines for application in solution-processable p-channel organic field-effect transistors
• Authors of publication: Anjali, Anshika; Lenka, Sambit Kumar; Imran, Predhanekar Mohamed; Bhuvanesh, Nattamai S. P.; Nagarajan, Samuthira
• Journal of publication: New Journal of Chemistry
• Year of publication: 2022
• Journal volume: 46
• Journal issue: 28
• Pages of publication: 13608 - 13614
• a: 9.4119 ± 0.0003 Å
• b: 16.8978 ± 0.0005 Å
• c: 10.9784 ± 0.0004 Å
• α: 90°
• β: 104.416 ± 0.001°
• γ: 90°
• Cell volume: 1691.03 ± 0.1 ų
• Cell temperature: 110 K
• Ambient diffraction temperature: 110 K
• Number of distinct elements: 4
• 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: 0.0577
• Residual factor for significantly intense reflections: 0.0557
• Weighted residual factors for significantly intense reflections: 0.1414
• Weighted residual factors for all reflections included in the refinement: 0.1434
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No