Information card for entry 7715975
| Formula |
C30 H20 B2 Br2 N2 |
| Calculated formula |
C30 H20 B2 Br2 N2 |
| Title of publication |
Borylation and rearrangement reactions of azasilaanthracenes to afford B,N-doped nanographenes |
| Authors of publication |
Zender, Elena; Valverde, Danillo; Neubaur, Robert; Karger, Sebastian; Virovets, Alexander; Bolte, Michael; Lerner, Hans-Wolfram; Olivier, Yoann; Wagner, Matthias |
| Journal of publication |
Dalton Transactions |
| Year of publication |
2024 |
| a |
10.4916 ± 0.0015 Å |
| b |
11.482 ± 0.0012 Å |
| c |
12.0304 ± 0.0012 Å |
| α |
66.894 ± 0.009° |
| β |
72.833 ± 0.01° |
| γ |
80.133 ± 0.01° |
| Cell volume |
1271 ± 0.3 Å3 |
| Cell temperature |
173 ± 2 K |
| Ambient diffraction temperature |
173 ± 2 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 |
0.0755 |
| Residual factor for significantly intense reflections |
0.0478 |
| Weighted residual factors for significantly intense reflections |
0.1045 |
| Weighted residual factors for all reflections included in the refinement |
0.1174 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.025 |
| 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/7715975.html
