Information card for entry 7237894

Structure parameters

• Common name: oTPA-DPPZ
• Chemical name: 4,4'-(dipyrido[3,2-a:2',3'-c]phenazine-11,12-diyl)bis(N,N-diphenylaniline)
• Formula: C54 H36 N6
• Calculated formula: C54 H36 N6
• Title of publication: A red thermally activated delayed fluorescence emitter employing dipyridophenazine with a gradient multi-inductive effect to improve radiation efficiency
• Authors of publication: Wang, Huiqin; Zhao, Bingjie; Ma, Peng; Li, Zhe; Wang, Xinyu; Zhao, Chenxi; Fan, Xiatao; Tao, Lilin; Duan, Chunbo; Zhang, Jing; Han, Chunmiao; Chen, Guanying; Xu, Hui
• Journal of publication: Journal of Materials Chemistry C
• Year of publication: 2019
• Journal volume: 7
• Journal issue: 25
• Pages of publication: 7525
• a: 11.5479 ± 0.0006 Å
• b: 12.0028 ± 0.0007 Å
• c: 19.1221 ± 0.0009 Å
• α: 97.337 ± 0.004°
• β: 101.2 ± 0.004°
• γ: 107.491 ± 0.005°
• Cell volume: 2430.2 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.3489
• Residual factor for significantly intense reflections: 0.2625
• Weighted residual factors for significantly intense reflections: 0.6066
• Weighted residual factors for all reflections included in the refinement: 0.6488
• Goodness-of-fit parameter for all reflections included in the refinement: 2.017
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No