Information card for entry 1554241

Structure parameters

• Common name: OTPA-BT-CN
• Chemical name: OTPA-BT-CN
• Formula: C109 H80 N16 O10 S4
• Calculated formula: C109 H80 N16 O10 S4
• Title of publication: The roles of thermally activated delayed fluorescence sensitizers for efficient red fluorescent organic light-emitting diodes with D‒A‒A type emitters
• Authors of publication: Wang, Ya-Kun; Huang, Chen-Chao; Kumar, Sarvendra; Wu, Sheng-Fan; Yuan, Yi; Aziz Khan, Aziz Khan; Jiang, Zuo-Quan; Fung, Man-Keung; Liao, Liang-Sheng
• Journal of publication: Materials Chemistry Frontiers
• Year of publication: 2019
• Journal volume: 3
• Journal issue: 1
• Pages of publication: 161
• a: 11.8289 ± 0.0011 Å
• b: 20.0485 ± 0.0017 Å
• c: 21.3871 ± 0.0018 Å
• α: 105.379 ± 0.003°
• β: 102.037 ± 0.004°
• γ: 99.001 ± 0.004°
• Cell volume: 4660.7 ± 0.7 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1214
• Residual factor for significantly intense reflections: 0.0648
• Weighted residual factors for significantly intense reflections: 0.1527
• Weighted residual factors for all reflections included in the refinement: 0.1812
• Goodness-of-fit parameter for all reflections included in the refinement: 1.003
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No