Information card for entry 7233483

Structure parameters

• Formula: C53 H32 N6
• Calculated formula: C53 H32 N6
• SMILES: C1(c2ccccc2c2ccccc12)(c1ccc(cc1)n1c2c(c3ccccc13)nc1c(cccc1)n2)c1ccc(cc1)n1c2c(c3ccccc13)nc1c(cccc1)n2
• Title of publication: Highly efficient deep-red organic electrophosphorescent devices with excellent operational stability using bis(indoloquinoxalinyl) derivatives as the host materials
• Authors of publication: Tsu-Hui Su; Chun-Hsiang Fan; Yu-Han Ou-Yang; Lun-Chia Hsu; Chien-Hong Cheng
• Journal of publication: Journal of Materials Chemistry C
• Year of publication: 2013
• Journal volume: 1
• Pages of publication: 5084 - 5092
• a: 8.6174 ± 0.0001 Å
• b: 11.3389 ± 0.0002 Å
• c: 19.7751 ± 0.0003 Å
• α: 92.949 ± 0.001°
• β: 98.462 ± 0.001°
• γ: 94.427 ± 0.001°
• Cell volume: 1901.66 ± 0.05 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: 0.0525
• Residual factor for significantly intense reflections: 0.0387
• Weighted residual factors for significantly intense reflections: 0.1034
• Weighted residual factors for all reflections included in the refinement: 0.1164
• Goodness-of-fit parameter for all reflections included in the refinement: 1.08
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No