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Information card for entry 7251238
Preview
| Coordinates | 7251238.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C4 H9 Li N4 Na O11 |
|---|---|
| Calculated formula | C4 H8 Li N4 Na O11 |
| Title of publication | Synthesis of Energetic Materials Derived from Hydroxynitropyrazine |
| Authors of publication | Jiang, Xiue; Xu, Zeyu; Fan, Mingren; Wang, Ruihui; Wang, Yi; Zhang, Qinghua |
| Journal of publication | CrystEngComm |
| Year of publication | 2025 |
| a | 7.8258 ± 0.0019 Å |
| b | 8.446 ± 0.002 Å |
| c | 10.152 ± 0.002 Å |
| α | 90.324 ± 0.008° |
| β | 100.963 ± 0.008° |
| γ | 116.811 ± 0.007° |
| Cell volume | 584.7 ± 0.2 Å3 |
| Cell temperature | 170 K |
| Ambient diffraction temperature | 170 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1673 |
| Residual factor for significantly intense reflections | 0.0932 |
| Weighted residual factors for significantly intense reflections | 0.2328 |
| Weighted residual factors for all reflections included in the refinement | 0.3104 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.053 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 303228 (current) | 2025-11-08 | cif/ Adding structures of 7251237, 7251238, 7251239 via cif-deposit CGI script. |
7251238.cif |
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Users of the data should acknowledge the original authors of the
structural data.