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Information card for entry 7247755
Preview
| Coordinates | 7247755.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C4 H6 K2 N11 O6 |
|---|---|
| Calculated formula | C4 H6 K2 N11 O6 |
| Title of publication | N-Methylene-C bridged tetrazole and 1,2,4-triazole energetic salts as promising primary explosives |
| Authors of publication | Zhang, Lingfeng; Wang, Yu; Wang, Yefeng; Liu, Shuai; Zhang, Na; Yang, Mingmin; Ma, Haixia; Guo, Zhaoqi |
| Journal of publication | CrystEngComm |
| Year of publication | 2024 |
| Journal volume | 26 |
| Journal issue | 2 |
| Pages of publication | 143 - 152 |
| a | 4.0899 ± 0.0018 Å |
| b | 8.238 ± 0.005 Å |
| c | 20.69 ± 0.011 Å |
| α | 96.88 ± 0.02° |
| β | 90.38 ± 0.04° |
| γ | 95.16 ± 0.03° |
| Cell volume | 689.2 ± 0.6 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0293 |
| Residual factor for significantly intense reflections | 0.0281 |
| Weighted residual factors for significantly intense reflections | 0.0802 |
| Weighted residual factors for all reflections included in the refinement | 0.0811 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.075 |
| Diffraction radiation wavelength | 1.34139 Å |
| Diffraction radiation type | GaKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 289448 (current) | 2024-02-04 | cif/ Updating files of 7247754, 7247755, 7247756, 7247757 Original log message: Adding full bibliography for 7247754--7247757.cif. |
7247755.cif |
| 287712 | 2023-11-22 | cif/ Adding structures of 7247754, 7247755, 7247756, 7247757 via cif-deposit CGI script. |
7247755.cif |
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Users of the data should acknowledge the original authors of the
structural data.