Information card for entry 7236201
| Formula |
C29 H17 B F4 N2 |
| Calculated formula |
C29 H17 B F4 N2 |
| Title of publication |
Synthesis, structure and photophysical properties of near-infrared 3,5-diarylbenzoBODIPY fluorophores |
| Authors of publication |
Wang, Jun; Wu, Qinghua; Xu, Yajun; Yu, Changjiang; Wei, Yun; Mu, Xiaolong; Hao, Erhong; Jiao, Lijuan |
| Journal of publication |
RSC Advances |
| Year of publication |
2016 |
| Journal volume |
6 |
| Journal issue |
57 |
| Pages of publication |
52180 |
| a |
12.1936 ± 0.0018 Å |
| b |
15.062 ± 0.002 Å |
| c |
12.2515 ± 0.0018 Å |
| α |
90° |
| β |
97.131 ± 0.002° |
| γ |
90° |
| Cell volume |
2232.7 ± 0.6 Å3 |
| Cell temperature |
293 ± 2 K |
| Ambient diffraction temperature |
293 ± 2 K |
| Number of distinct elements |
5 |
| Space group number |
14 |
| Hermann-Mauguin space group symbol |
P 1 21/n 1 |
| Hall space group symbol |
-P 2yn |
| Residual factor for all reflections |
0.0873 |
| Residual factor for significantly intense reflections |
0.0517 |
| Weighted residual factors for significantly intense reflections |
0.1215 |
| Weighted residual factors for all reflections included in the refinement |
0.1418 |
| Goodness-of-fit parameter for all reflections included in the refinement |
0.999 |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
No |
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https://www.crystallography.net/7236201.html
