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Information card for entry 7245565
Preview
| Coordinates | 7245565.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C20 H17 I2 N O2 |
|---|---|
| Calculated formula | C20 H17 I2 N O2 |
| SMILES | c1ccccc1C(=C1\C(=O)N(C(=O)C1(C)CI)Cc1ccccc1)\I |
| Title of publication | Highly efficient and fast synthesis of di-iodinated succinimide derivatives from 1,6-enyne and I2 under air at room temperature |
| Authors of publication | Lu, Yuling; Chen, Chunmei; Zhu, Hucheng; Luo, Zengwei; Zhang, Yonghui |
| Journal of publication | Green Chemistry |
| Year of publication | 2022 |
| Journal volume | 24 |
| Journal issue | 20 |
| Pages of publication | 8021 - 8028 |
| a | 7.6126 ± 0.0001 Å |
| b | 23.4046 ± 0.0002 Å |
| c | 11.2824 ± 0.0001 Å |
| α | 90° |
| β | 103.859 ± 0.001° |
| γ | 90° |
| Cell volume | 1951.66 ± 0.04 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0433 |
| Residual factor for significantly intense reflections | 0.0432 |
| Weighted residual factors for significantly intense reflections | 0.1279 |
| Weighted residual factors for all reflections included in the refinement | 0.128 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.096 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 278985 (current) | 2022-11-07 | cif/ Updating files of 7245565 Original log message: Adding full bibliography for 7245565.cif. |
7245565.cif |
| 278141 | 2022-09-24 | cif/ Adding structures of 7245565 via cif-deposit CGI script. |
7245565.cif |
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Users of the data should acknowledge the original authors of the
structural data.