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Information card for entry 7157988
Preview
| Coordinates | 7157988.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C11 H12 N2 O4 S |
|---|---|
| Calculated formula | C11 H12 N2 O4 S |
| Title of publication | An organophotoredox-catalyzed C(sp<sup>2</sup>)-N cross coupling reaction of cyclic aldimines with cyclic aliphatic amines. |
| Authors of publication | Liu, Xue; Wang, Jingjing; Wu, Ziyan; Li, Feng; Gao, Kexin; Peng, Fanyang; Wang, Junjie; Shen, Renzeng; Zhou, Yao; Liu, Lantao |
| Journal of publication | Organic & biomolecular chemistry |
| Year of publication | 2021 |
| Journal volume | 19 |
| Journal issue | 16 |
| Pages of publication | 3595 - 3600 |
| a | 8.4413 ± 0.0011 Å |
| b | 8.917 ± 0.0013 Å |
| c | 9.0986 ± 0.0011 Å |
| α | 95.122 ± 0.005° |
| β | 107.332 ± 0.005° |
| γ | 113.574 ± 0.004° |
| Cell volume | 581.96 ± 0.14 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 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 | 0.0421 |
| Residual factor for significantly intense reflections | 0.0321 |
| Weighted residual factors for significantly intense reflections | 0.0832 |
| Weighted residual factors for all reflections included in the refinement | 0.0888 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.048 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 264941 (current) | 2021-05-05 | cif/ Updating files of 7157988 Original log message: Adding full bibliography for 7157988.cif. |
7157988.cif |
| 263303 | 2021-03-25 | cif/ Adding structures of 7157988 via cif-deposit CGI script. |
7157988.cif |
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Users of the data should acknowledge the original authors of the
structural data.