Information card for entry 7048935
| Formula |
C5 H15 N11 O6 |
| Calculated formula |
C5 H15 N11 O6 |
| Title of publication |
Tetrazolyl and dinitromethyl groups with 1,2,3-triazole lead to polyazole energetic materials. |
| Authors of publication |
Liu, Yingle; He, Chunlin; Tang, Yongxing; Imler, Gregory H.; Parrish, Damon A.; Shreeve, Jean'ne M. |
| Journal of publication |
Dalton transactions (Cambridge, England : 2003) |
| Year of publication |
2019 |
| Journal volume |
48 |
| Journal issue |
10 |
| Pages of publication |
3237 - 3242 |
| a |
7.5623 ± 0.0011 Å |
| b |
10.2596 ± 0.0015 Å |
| c |
19.026 ± 0.003 Å |
| α |
97.88 ± 0.002° |
| β |
91.529 ± 0.002° |
| γ |
109.537 ± 0.002° |
| Cell volume |
1373.9 ± 0.4 Å3 |
| Cell temperature |
173 ± 2 K |
| Ambient diffraction temperature |
173 ± 2 K |
| Number of distinct elements |
4 |
| Space group number |
2 |
| Hermann-Mauguin space group symbol |
P -1 |
| Hall space group symbol |
-P 1 |
| Residual factor for all reflections |
0.0832 |
| Residual factor for significantly intense reflections |
0.0681 |
| Weighted residual factors for significantly intense reflections |
0.2307 |
| Weighted residual factors for all reflections included in the refinement |
0.2425 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.075 |
| 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/7048935.html
