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Information card for entry 1573538
Preview
| Coordinates | 1573538.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | <i>N</i>-[(<i>E</i>)-(4-Hydroxyphenyl)methylidene]-1<i>H</i>-1,2,4-triazol-3-amine |
|---|---|
| Formula | C9 H10 N4 O2 |
| Calculated formula | C9 H10 N4 O2 |
| Authors of publication | Boutheina, Boualia; Zakaria, Bouhidel; Cherouana, Aouatef; El-Eulmi, Bendeif |
| Year of publication | 2024 |
| a | 3.7638 ± 0.0001 Å |
| b | 9.286 ± 0.003 Å |
| c | 26.194 ± 0.002 Å |
| α | 90° |
| β | 93.786 ± 0.002° |
| γ | 90° |
| Cell volume | 913.5 ± 0.3 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100 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 | 0.0761 |
| Residual factor for significantly intense reflections | 0.0476 |
| Weighted residual factors for significantly intense reflections | 0.1193 |
| Weighted residual factors for all reflections included in the refinement | 0.1385 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.098 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 296967 (current) | 2024-12-25 | cif/ Adding structures of 1573538 via cif-deposit CGI script. |
1573538.cif |
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