Information card for entry 7245737
| Formula |
C22 H28 N2 O2 |
| Calculated formula |
C22 H28 N2 O2 |
| Title of publication |
Facile synthesis of isoquinolines and isoquinoline N-oxides via a copper-catalyzed intramolecular cyclization in water |
| Authors of publication |
Zhang, Lujun; Xiong, Wenfang; Yao, Biao; Liu, Haitao; Li, Meng; Qin, Yu; Yu, Yujian; Li, Xu; Chen, Meng; Wu, Wanqing; Li, Jianxiao; Wang, Jinliang; Jiang, Huanfeng |
| Journal of publication |
RSC Advances |
| Year of publication |
2022 |
| Journal volume |
12 |
| Journal issue |
47 |
| Pages of publication |
30248 - 30252 |
| a |
22.8147 ± 0.0012 Å |
| b |
22.8147 ± 0.0012 Å |
| c |
10.5217 ± 0.0007 Å |
| α |
90° |
| β |
90° |
| γ |
120° |
| Cell volume |
4742.9 ± 0.5 Å3 |
| Cell temperature |
150 K |
| Ambient diffraction temperature |
150 K |
| Number of distinct elements |
4 |
| Space group number |
148 |
| Hermann-Mauguin space group symbol |
R -3 :H |
| Hall space group symbol |
-R 3 |
| Residual factor for all reflections |
0.1042 |
| Residual factor for significantly intense reflections |
0.0565 |
| Weighted residual factors for significantly intense reflections |
0.1309 |
| Weighted residual factors for all reflections included in the refinement |
0.1559 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.02 |
| 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/7245737.html
