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Information card for entry 7245203
Preview
| Coordinates | 7245203.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C17 H17 N3 O4 S |
|---|---|
| Calculated formula | C17 H17 N3 O4 S |
| SMILES | S(=O)(=O)(Nc1nc2n(c1C(=O)OCC)cccc2)c1ccc(cc1)C |
| Title of publication | Copper-catalyzed three-component reaction to synthesize polysubstituted imidazo[1,2-a]pyridines |
| Authors of publication | Zhou, Zitong; Luo, Danyang; Li, Guanrong; Yang, Zhongtao; Cui, Liao; Yang, Weiguang |
| Journal of publication | RSC Advances |
| Year of publication | 2022 |
| Journal volume | 12 |
| Journal issue | 31 |
| Pages of publication | 20199 - 20205 |
| a | 8.7875 ± 0.0005 Å |
| b | 8.8129 ± 0.0005 Å |
| c | 11.7354 ± 0.0006 Å |
| α | 93.835 ± 0.002° |
| β | 111.598 ± 0.002° |
| γ | 96.227 ± 0.002° |
| Cell volume | 834.41 ± 0.08 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 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 | 0.0481 |
| Residual factor for significantly intense reflections | 0.0388 |
| Weighted residual factors for significantly intense reflections | 0.1068 |
| Weighted residual factors for all reflections included in the refinement | 0.1133 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.046 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 276882 (current) | 2022-07-23 | cif/ Adding structures of 7245203 via cif-deposit CGI script. |
7245203.cif |
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Users of the data should acknowledge the original authors of the
structural data.