Information card for entry 7237013

Structure parameters

• Chemical name: 7,9-dihexyl-5,6,10,11-tetrahydrobenzo[h]benzo[7,8]quinolino[3,2-b]acridine
• Formula: C40 H44 N2
• Calculated formula: C40 H44 N2
• Title of publication: A Friedländer route to 5,7-diazapentacenes
• Authors of publication: Lunchev, Andrey V.; Hendrata, Vincent C.; Jaggi, Aparna; Morris, Samuel A.; Ganguly, Rakesh; Chen, Xiaoxuan; Sun, Handong; Grimsdale, Andrew C.
• Journal of publication: Journal of Materials Chemistry C
• Year of publication: 2018
• Journal volume: 6
• Journal issue: 14
• Pages of publication: 3715
• a: 8.8518 ± 0.0019 Å
• b: 12.613 ± 0.003 Å
• c: 14.689 ± 0.003 Å
• α: 89.365 ± 0.002°
• β: 86.918 ± 0.002°
• γ: 74.577 ± 0.002°
• Cell volume: 1578.6 ± 0.6 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1005
• Residual factor for significantly intense reflections: 0.0623
• Weighted residual factors for significantly intense reflections: 0.1391
• Weighted residual factors for all reflections included in the refinement: 0.1582
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No