Information card for entry 1572153
| Formula |
C42 H35 N3 O4 |
| Calculated formula |
C42 H35 N3 O4 |
| 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 |
11.4007 ± 0.0003 Å |
| b |
12.6971 ± 0.0003 Å |
| c |
23.0034 ± 0.0006 Å |
| α |
90° |
| β |
90° |
| γ |
90° |
| Cell volume |
3329.88 ± 0.15 Å3 |
| Cell temperature |
193 K |
| Ambient diffraction temperature |
193 K |
| Number of distinct elements |
4 |
| Space group number |
19 |
| Hermann-Mauguin space group symbol |
P 21 21 21 |
| Hall space group symbol |
P 2ac 2ab |
| Residual factor for all reflections |
0.0249 |
| Residual factor for significantly intense reflections |
0.0245 |
| Weighted residual factors for significantly intense reflections |
0.0645 |
| Weighted residual factors for all reflections included in the refinement |
0.0648 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.054 |
| Diffraction radiation wavelength |
1.54178 Å |
| Diffraction radiation type |
CuKα |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
No |
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The link is:
https://www.crystallography.net/1572153.html
