Information card for entry 7063788
| Formula |
C6 H8 N6 |
| Calculated formula |
C6 H8 N6 |
| Title of publication |
4,4′-Dimethyl-1,1′-bi(1,2,3-triazole): exploring new insensitive energy source materials |
| Authors of publication |
Li, Hao; Zhang, Guang-yuan; Du, Ning-ning; Zhan, Le-wu; Hou, Jing; Li, Bin-dong |
| Journal of publication |
New Journal of Chemistry |
| Year of publication |
2025 |
| Journal volume |
49 |
| Journal issue |
20 |
| Pages of publication |
8437 - 8441 |
| a |
16.877 ± 0.005 Å |
| b |
23.183 ± 0.007 Å |
| c |
4.0775 ± 0.0012 Å |
| α |
90° |
| β |
90° |
| γ |
90° |
| Cell volume |
1595.4 ± 0.8 Å3 |
| Cell temperature |
296 ± 2 K |
| Ambient diffraction temperature |
296 ± 2 K |
| Number of distinct elements |
3 |
| Space group number |
43 |
| Hermann-Mauguin space group symbol |
F d d 2 |
| Hall space group symbol |
F 2 -2d |
| Residual factor for all reflections |
0.0504 |
| Residual factor for significantly intense reflections |
0.0376 |
| Weighted residual factors for significantly intense reflections |
0.0917 |
| Weighted residual factors for all reflections included in the refinement |
0.0982 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.045 |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
No |
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https://www.crystallography.net/7063788.html
