Information card for entry 1572798
| Chemical name |
DB-SF2 |
| 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 |
14.1931 ± 0.0011 Å |
| b |
16.6449 ± 0.0012 Å |
| c |
17.7614 ± 0.0014 Å |
| α |
71.081 ± 0.003° |
| β |
69.022 ± 0.004° |
| γ |
78.65 ± 0.004° |
| Cell volume |
3690.7 ± 0.5 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 |
0.1824 |
| Residual factor for significantly intense reflections |
0.1112 |
| Weighted residual factors for significantly intense reflections |
0.3059 |
| Weighted residual factors for all reflections included in the refinement |
0.3547 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.067 |
| 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/1572798.html
