Information card for entry 7712302
| Formula |
C36 H44 Br2 N4 O2 Pd |
| Calculated formula |
C36 H44 Br2 N4 O2 Pd |
| Title of publication |
Versatile halogenation <i>via</i> a C<sub>NHC</sub>^C<sub>sp3</sub> palladacycle intermediate. |
| Authors of publication |
Teng, Qiaoqiao; Liu, Ziwei; Song, Haobin; Liu, Jiayu; Zhao, Yaru; Jiang, Weihua; Huynh, Han Vinh; Meng, Qi |
| Journal of publication |
Dalton transactions (Cambridge, England : 2003) |
| Year of publication |
2023 |
| Journal volume |
52 |
| Journal issue |
8 |
| Pages of publication |
2223 - 2226 |
| a |
9.5373 ± 0.0005 Å |
| b |
12.3311 ± 0.0007 Å |
| c |
16.2241 ± 0.0009 Å |
| α |
93.233 ± 0.002° |
| β |
92.079 ± 0.002° |
| γ |
110.721 ± 0.002° |
| Cell volume |
1778.55 ± 0.17 Å3 |
| Cell temperature |
150 K |
| Ambient diffraction temperature |
150 K |
| Number of distinct elements |
6 |
| Space group number |
2 |
| Hermann-Mauguin space group symbol |
P -1 |
| Hall space group symbol |
-P 1 |
| Residual factor for all reflections |
0.0614 |
| Residual factor for significantly intense reflections |
0.0414 |
| Weighted residual factors for significantly intense reflections |
0.0855 |
| Weighted residual factors for all reflections included in the refinement |
0.0958 |
| Goodness-of-fit parameter for all reflections included in the refinement |
0.99 |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
Yes |
| Has Fobs |
No |
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https://www.crystallography.net/7712302.html
