Information card for entry 7234305

Structure parameters

• Common name: TPO-DBBO
• Chemical name: 4,8-bis(4-yl-triphenylphosphine oxide)-2,6-dimethylbenzo [1,2-d:4,5-d']bis(oxazole)
• Formula: C48 H42 N2 O6 P2
• Calculated formula: C48 H42 N2 O6 P2
• Title of publication: Benzobisoxazole-based electron transporting materials with high Tg and ambipolar property: high efficiency deep-red phosphorescent OLEDs
• Authors of publication: Xiaojun Yin; Tingke Zhang; Qiming Peng; Tao Zhou; Weixuan Zeng; Zece Zhu; Guohua Xie; Feng Li; Dongge Ma; Chuluo Yang
• Journal of publication: Journal of Materials Chemistry C
• Year of publication: 2015
• Journal volume: 3
• Pages of publication: 7589 - 7596
• a: 9.8428 ± 0.0015 Å
• b: 17.45 ± 0.003 Å
• c: 12.4113 ± 0.0019 Å
• α: 90°
• β: 101.866 ± 0.002°
• γ: 90°
• Cell volume: 2086.2 ± 0.6 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 2 K
• Number of distinct elements: 5
• 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: 0.07
• Residual factor for significantly intense reflections: 0.0624
• Weighted residual factors for significantly intense reflections: 0.2009
• Weighted residual factors for all reflections included in the refinement: 0.219
• Goodness-of-fit parameter for all reflections included in the refinement: 1.09
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No