Information card for entry 7205912

Structure parameters

• Formula: C42 H27 N3
• Calculated formula: C42 H27 N3
• SMILES: n1(c2cc(n3c4ccccc4c4ccccc34)ccc2c2ccc(n3c4ccccc4c4ccccc34)cc12)c1ccccc1
• Title of publication: High-triplet-energy tri-carbazole derivatives as host materials for efficient solution-processed blue phosphorescent devices
• Authors of publication: Jiang, Wei; Duan, Lian; Qiao, Juan; Dong, Guifang; Zhang, Deqiang; Wang, Liduo; Qiu, Yong
• Journal of publication: Journal of Materials Chemistry
• Year of publication: 2011
• Journal volume: 21
• Journal issue: 13
• Pages of publication: 4918
• a: 26.259 ± 0.005 Å
• b: 14.225 ± 0.003 Å
• c: 16.316 ± 0.003 Å
• α: 90°
• β: 94.423 ± 0.004°
• γ: 90°
• Cell volume: 6076 ± 2 ų
• Cell temperature: 299 ± 2 K
• Ambient diffraction temperature: 299 ± 2 K
• Number of distinct elements: 3
• 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: 0.1939
• Residual factor for significantly intense reflections: 0.094
• Weighted residual factors for significantly intense reflections: 0.1153
• Weighted residual factors for all reflections included in the refinement: 0.135
• Goodness-of-fit parameter for all reflections included in the refinement: 1.082
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No