Information card for entry 1572797
| Chemical name |
DB-SF1 |
| Formula |
C86 H59 B2 N3 |
| Calculated formula |
C86 H59 B2 N3 |
| Title of publication |
High-Performance Deep-Blue Electroluminescence from Multi-resonance TADF Emitters with Spirofluorene-Fused Double Boron Framework |
| Authors of publication |
Xu, Ke; Li, Nengquan; Ye, Zeyuan; Guo, Yuxi; Wu, Yuxin; Gui, Chenghao; Yin, Xiaojun; Miao, Jingsheng; Cao, Xiaosong; Yang, Chuluo |
| Journal of publication |
Chemical Science |
| Year of publication |
2024 |
| a |
13.8977 ± 0.0006 Å |
| b |
16.6183 ± 0.0007 Å |
| c |
20.3259 ± 0.0008 Å |
| α |
113.405 ± 0.001° |
| β |
95.369 ± 0.002° |
| γ |
91.274 ± 0.002° |
| Cell volume |
4280.2 ± 0.3 Å3 |
| Cell temperature |
170 K |
| Ambient diffraction temperature |
170 K |
| Number of distinct elements |
4 |
| Space group number |
2 |
| Hermann-Mauguin space group symbol |
P -1 |
| Hall space group symbol |
-P 1 |
| Residual factor for all reflections |
0.1026 |
| Residual factor for significantly intense reflections |
0.0861 |
| Weighted residual factors for significantly intense reflections |
0.277 |
| Weighted residual factors for all reflections included in the refinement |
0.2896 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.04 |
| Diffraction radiation wavelength |
1.34139 Å |
| Diffraction radiation type |
GaKα |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
No |
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The link is:
https://www.crystallography.net/1572797.html
