Information card for entry 4515364

Structure parameters

• Formula: C32 H18 N4
• Calculated formula: C32 H18 N4
• SMILES: c1(c(cc(c(c1)C#N)C#N)n1c2ccccc2c2ccccc12)n1c2ccccc2c2ccccc12
• Title of publication: Heavy Atom Effect of Bromine Significantly Enhances Exciton Utilization of Delayed Fluorescence Luminogens.
• Authors of publication: Gan, Shifeng; Hu, Shimin; Li, Xiang-Long; Zeng, Jiajie; Zhang, Dongdong; Huang, Tianyu; Luo, Wenwen; Zhao, Zujin; Duan, Lian; Su, Shi-Jian; Tang, Ben Zhong
• Journal of publication: ACS applied materials & interfaces
• Year of publication: 2018
• Journal volume: 10
• Journal issue: 20
• Pages of publication: 17327 - 17334
• a: 12.0465 ± 0.0016 Å
• b: 13.7062 ± 0.0017 Å
• c: 15.25 ± 0.002 Å
• α: 94.068 ± 0.004°
• β: 96.317 ± 0.004°
• γ: 105.134 ± 0.004°
• Cell volume: 2402.8 ± 0.5 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.1847
• Residual factor for significantly intense reflections: 0.0525
• Weighted residual factors for significantly intense reflections: 0.0725
• Weighted residual factors for all reflections included in the refinement: 0.0952
• Goodness-of-fit parameter for all reflections included in the refinement: 0.889
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No