Information card for entry 7207934

Structure parameters

• Formula: C56 H36 N6
• Calculated formula: C56 H36 N6
• SMILES: c12c(n(c3ccccc13)c1ccc(cc1)n1c3ccccc3nc1c1ccccc1)cc1c(c2)n(c2ccccc12)c1ccc(n2c3ccccc3nc2c2ccccc2)cc1
• Title of publication: Indolo[3,2-b]carbazole/benzimidazole hybrid bipolar host materials for highly efficient red, yellow, and green phosphorescent organic light emitting diodes
• Authors of publication: Ting, Hao-Chun; Chen, You-Ming; You, Hong-Wei; Hung, Wen-Yi; Lin, Sheng-Hsun; Chaskar, Atul; Chou, Shu-Hua; Chi, Yun; Liu, Rai-Hsung; Wong, Ken-Tsung
• Journal of publication: Journal of Materials Chemistry
• Year of publication: 2012
• Journal volume: 22
• Journal issue: 17
• Pages of publication: 8399
• a: 9.3415 ± 0.0006 Å
• b: 10.0537 ± 0.0007 Å
• c: 11.5245 ± 0.0009 Å
• α: 106.117 ± 0.007°
• β: 99.662 ± 0.006°
• γ: 93.529 ± 0.005°
• Cell volume: 1018.35 ± 0.13 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 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: 0.0617
• Residual factor for significantly intense reflections: 0.047
• Weighted residual factors for significantly intense reflections: 0.1332
• Weighted residual factors for all reflections included in the refinement: 0.1538
• Goodness-of-fit parameter for all reflections included in the refinement: 1.001
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No