Information card for entry 1572152
| Formula |
C38 H33 Br N2 O2 |
| Calculated formula |
C38 H33 Br N2 O2 |
| Title of publication |
Access to distal biaxial atropisomers by iridium catalyzed asymmetric C-H alkylation. |
| Authors of publication |
Hu, Xueqing; Zhao, Yunxu; He, Tong; Niu, Caoyue; Liu, Feipeng; Jia, Wei; Mu, Yi; Li, Xingwei; Rong, Zi-Qiang |
| Journal of publication |
Chemical science |
| Year of publication |
2024 |
| Journal volume |
15 |
| Journal issue |
33 |
| Pages of publication |
13541 - 13549 |
| a |
12.7215 ± 0.0005 Å |
| b |
15.7043 ± 0.0006 Å |
| c |
16.4829 ± 0.0006 Å |
| α |
99.04 ± 0.001° |
| β |
90.039 ± 0.001° |
| γ |
111.104 ± 0.002° |
| Cell volume |
3028.1 ± 0.2 Å3 |
| Cell temperature |
193 K |
| Ambient diffraction temperature |
193 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 |
0.109 |
| Residual factor for significantly intense reflections |
0.0574 |
| Weighted residual factors for significantly intense reflections |
0.1179 |
| Weighted residual factors for all reflections included in the refinement |
0.144 |
| Goodness-of-fit parameter for all reflections included in the refinement |
0.995 |
| Diffraction radiation probe |
x-ray |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
Yes |
| Has Fobs |
No |
For the version history of this entry, please navigate to main COD server.
The link is:
https://www.crystallography.net/1572152.html
