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Information card for entry 7134847
Preview
| Coordinates | 7134847.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | 1,4,5,8-Tetraazanaphthalene |
|---|---|
| Formula | C6 H4 N4 |
| Calculated formula | C6 H4 N4 |
| Title of publication | Isolation of 1,4,5,8-tetraazanaphthalene radicals |
| Authors of publication | Deshapriya, Saroshan; Demir, Selvan |
| Journal of publication | Chemical Communications |
| Year of publication | 2025 |
| a | 3.6563 ± 0.0002 Å |
| b | 7.4254 ± 0.0004 Å |
| c | 10.3507 ± 0.0005 Å |
| α | 90° |
| β | 94.82 ± 0.005° |
| γ | 90° |
| Cell volume | 280.02 ± 0.03 Å3 |
| Cell temperature | 99.98 ± 0.1 K |
| Ambient diffraction temperature | 99.98 ± 0.1 K |
| Number of distinct elements | 3 |
| 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 | 0.043 |
| Residual factor for significantly intense reflections | 0.0411 |
| Weighted residual factors for significantly intense reflections | 0.1116 |
| Weighted residual factors for all reflections included in the refinement | 0.1139 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.098 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301377 (current) | 2025-07-29 | cif/ Adding structures of 7134847, 7134848, 7134849 via cif-deposit CGI script. |
7134847.cif |
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Users of the data should acknowledge the original authors of the
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