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Information card for entry 7245402
Preview
| Coordinates | 7245402.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C21 H24 N4 O |
|---|---|
| Calculated formula | C21 H24 N4 O |
| SMILES | o1c(nc(/N=N/N(C(C)C)C(C)C)c1c1ccccc1)c1ccccc1 |
| Title of publication | Gold-catalyzed synthesis of oxazoles from alkynyl triazenes and dioxazoles |
| Authors of publication | Mao, Zhenjun; Zeng, Hao |
| Journal of publication | RSC Advances |
| Year of publication | 2022 |
| Journal volume | 12 |
| Journal issue | 38 |
| Pages of publication | 24857 - 24860 |
| a | 20.6474 ± 0.0005 Å |
| b | 8.3478 ± 0.0002 Å |
| c | 11.4696 ± 0.0003 Å |
| α | 90° |
| β | 102.688 ± 0.001° |
| γ | 90° |
| Cell volume | 1928.63 ± 0.08 Å3 |
| Cell temperature | 169 ± 2 K |
| Ambient diffraction temperature | 169 K |
| Number of distinct elements | 4 |
| 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 | 0.0462 |
| Residual factor for significantly intense reflections | 0.04 |
| Weighted residual factors for significantly intense reflections | 0.0967 |
| Weighted residual factors for all reflections included in the refinement | 0.1014 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.025 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 277530 (current) | 2022-09-01 | cif/ Adding structures of 7245402 via cif-deposit CGI script. |
7245402.cif |
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Users of the data should acknowledge the original authors of the
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