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Information card for entry 7160424
Preview
| Coordinates | 7160424.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C23 H15 N3 O2 |
|---|---|
| Calculated formula | C23 H15 N3 O2 |
| Title of publication | Silver-free, palladium-catalyzed arylation of pyrrolo[1,2-a]quinoxaline C−H bonds with aryl bromides |
| Authors of publication | Ong, Khanh; Nguyen, Ha; Nguyen, Anh T.; Luu, Vu; Tran, Dat; Ca, Thuy T.; Doan, Tan Le Hoang; Hung, Huy Nguyen; Nguyen, Tung |
| Journal of publication | Organic & Biomolecular Chemistry |
| Year of publication | 2025 |
| a | 12.3695 ± 0.0002 Å |
| b | 7.3785 ± 0.0001 Å |
| c | 18.8523 ± 0.0004 Å |
| α | 90° |
| β | 92.702 ± 0.001° |
| γ | 90° |
| Cell volume | 1718.71 ± 0.05 Å3 |
| Cell temperature | 296.15 K |
| Ambient diffraction temperature | 296.15 K |
| Number of distinct elements | 4 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.094 |
| Residual factor for significantly intense reflections | 0.0598 |
| Weighted residual factors for significantly intense reflections | 0.1201 |
| Weighted residual factors for all reflections included in the refinement | 0.1506 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.122 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 298496 (current) | 2025-03-18 | cif/ Adding structures of 7160424 via cif-deposit CGI script. |
7160424.cif |
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Users of the data should acknowledge the original authors of the
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