Information card for entry 4135016
| Formula |
C34 H31 Cl4 N4 Ni2 O2 |
| Calculated formula |
C34 H31 Cl4 N4 Ni2 O2 |
| Title of publication |
Enantioselective Ni-Catalyzed Electrochemical Synthesis of Biaryl Atropisomers. |
| Authors of publication |
Qiu, Hui; Shuai, Bin; Wang, Yun-Zhao; Liu, Dong; Chen, Yue-Gang; Gao, Pei-Sen; Ma, Hong-Xing; Chen, Song; Mei, Tian-Sheng |
| Journal of publication |
Journal of the American Chemical Society |
| Year of publication |
2020 |
| Journal volume |
142 |
| Journal issue |
22 |
| Pages of publication |
9872 - 9878 |
| a |
10.9629 ± 0.0005 Å |
| b |
9.5777 ± 0.0004 Å |
| c |
17.0234 ± 0.0008 Å |
| α |
90° |
| β |
108.478 ± 0.001° |
| γ |
90° |
| Cell volume |
1695.3 ± 0.13 Å3 |
| Cell temperature |
293 ± 2 K |
| Ambient diffraction temperature |
293 ± 2 K |
| Number of distinct elements |
6 |
| Space group number |
4 |
| Hermann-Mauguin space group symbol |
P 1 21 1 |
| Hall space group symbol |
P 2yb |
| Residual factor for all reflections |
0.0311 |
| Residual factor for significantly intense reflections |
0.0264 |
| Weighted residual factors for significantly intense reflections |
0.0585 |
| Weighted residual factors for all reflections included in the refinement |
0.0609 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.042 |
| 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/4135016.html
