Information card for entry 1572409
| Formula |
C70 H60 B N3 |
| Calculated formula |
C70 H60 B N3 |
| Title of publication |
Efficient circularly polarized multiple resonance thermally activated delayed fluorescence from B,N-embedded hetero[8]helicene enantiomers |
| Authors of publication |
Huang, Tingting; Yuan, Li; Lu, Xueying; Qu, Yupei; Qu, Cheng; Xu, Yincai; Zheng, You-Xuan; Wang, Yue |
| Journal of publication |
Chemical Science |
| Year of publication |
2024 |
| a |
11.1226 ± 0.0007 Å |
| b |
15.8329 ± 0.0009 Å |
| c |
15.9866 ± 0.0009 Å |
| α |
104.893 ± 0.002° |
| β |
90.229 ± 0.002° |
| γ |
96.128 ± 0.002° |
| Cell volume |
2703.7 ± 0.3 Å3 |
| Cell temperature |
295 K |
| Ambient diffraction temperature |
295 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 |
0.1271 |
| Residual factor for significantly intense reflections |
0.0762 |
| Weighted residual factors for significantly intense reflections |
0.1967 |
| Weighted residual factors for all reflections included in the refinement |
0.241 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.028 |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
Yes |
| Has Fobs |
No |
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The link is:
https://www.crystallography.net/1572409.html
