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Information card for entry 1572878
Preview
| Coordinates | 1572878.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C24 H18 N2 O3 |
|---|---|
| Calculated formula | C24 H18 N2 O3 |
| SMILES | O1C(=N[C@]2(C(=O)NC(=O)[C@@]12c1ccccc1)Cc1ccccc1)c1ccccc1 |
| Title of publication | Catalytic asymmetric Michael and Nef-type sequential reaction of nitroolefin with azlactone to construct oxazole-fused succinimide. |
| Authors of publication | Weng, Rui; Zhou, Yuqiao; Zhang, Yaqin; Feng, Xiaoming; Liu, Xiaohua |
| Journal of publication | Chemical communications (Cambridge, England) |
| Year of publication | 2024 |
| Journal volume | 60 |
| Journal issue | 91 |
| Pages of publication | 13384 - 13387 |
| a | 8.6718 ± 0.0003 Å |
| b | 9.0165 ± 0.0003 Å |
| c | 24.3506 ± 0.0009 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1903.96 ± 0.12 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 19 |
| Hermann-Mauguin space group symbol | P 21 21 21 |
| Hall space group symbol | P 2ac 2ab |
| Residual factor for all reflections | 0.0568 |
| Residual factor for significantly intense reflections | 0.0533 |
| Weighted residual factors for significantly intense reflections | 0.1358 |
| Weighted residual factors for all reflections included in the refinement | 0.1429 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.068 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 296315 (current) | 2024-12-06 | cif/ Updating files of 1572878 Original log message: Adding full bibliography for 1572878.cif. |
1572878.cif |
| 295519 | 2024-10-18 | cif/ Adding structures of 1572878 via cif-deposit CGI script. |
1572878.cif |
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Users of the data should acknowledge the original authors of the
structural data.