Information card for entry 7127769
| Formula |
C136 H142 B2 F4 N4 |
| Calculated formula |
C136 H142 B2 F4 N4 |
| Title of publication |
Highly regioselective palladium-catalyzed domino reaction for post-functionalization of BODIPY. |
| Authors of publication |
Wang, Sisi; Wang, Zhaoli; Gao, Hu; Jiang, Liang; Liu, Hui; Wu, Fan; Zhao, Yue; Chan, Kin Shing; Shen, Zhen |
| Journal of publication |
Chemical communications (Cambridge, England) |
| Year of publication |
2021 |
| Journal volume |
57 |
| Journal issue |
14 |
| Pages of publication |
1758 - 1761 |
| a |
15.7803 ± 0.0006 Å |
| b |
16.9989 ± 0.0006 Å |
| c |
21.4911 ± 0.0008 Å |
| α |
90.149 ± 0.002° |
| β |
91.366 ± 0.002° |
| γ |
90.205 ± 0.002° |
| Cell volume |
5763.2 ± 0.4 Å3 |
| Cell temperature |
189.99 K |
| Ambient diffraction temperature |
189.99 K |
| Number of distinct elements |
5 |
| Space group number |
2 |
| Hermann-Mauguin space group symbol |
P -1 |
| Hall space group symbol |
-P 1 |
| Residual factor for all reflections |
0.1041 |
| Residual factor for significantly intense reflections |
0.0732 |
| Weighted residual factors for significantly intense reflections |
0.1943 |
| Weighted residual factors for all reflections included in the refinement |
0.2243 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.047 |
| Diffraction radiation wavelength |
1.34138 Å |
| Diffraction radiation type |
GaKα |
| Has coordinates |
Yes |
| Has disorder |
Yes |
| Has Fobs |
No |
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https://www.crystallography.net/7127769.html
