Information card for entry 7231977
Formula |
C2 Cs2 N8 O4 |
Calculated formula |
C2 Cs2 N8 O4 |
Title of publication |
Alkali metal salts of 3,6-dinitramino-1,2,4,5-tetrazine: promising nitrogen-rich energetic materials |
Authors of publication |
Zhang, Tianhe; Du, Jiang; Li, Zhimin; Lin, Xinyu; Wang, Lin; Yang, Li; Zhang, Tonglai |
Journal of publication |
CrystEngComm |
Year of publication |
2019 |
Journal volume |
21 |
Journal issue |
4 |
Pages of publication |
765 |
a |
5.3925 ± 0.0011 Å |
b |
7.3559 ± 0.0015 Å |
c |
7.4275 ± 0.0015 Å |
α |
61.64 ± 0.03° |
β |
87.56 ± 0.03° |
γ |
69.5 ± 0.03° |
Cell volume |
240.09 ± 0.13 Å3 |
Cell temperature |
153 ± 2 K |
Ambient diffraction temperature |
153.15 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 |
0.0398 |
Residual factor for significantly intense reflections |
0.0394 |
Weighted residual factors for significantly intense reflections |
0.0966 |
Weighted residual factors for all reflections included in the refinement |
0.097 |
Goodness-of-fit parameter for all reflections included in the refinement |
1.085 |
Diffraction radiation wavelength |
0.71073 Å |
Diffraction radiation type |
MoKα |
Has coordinates |
Yes |
Has disorder |
No |
Has Fobs |
No |
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The link is:
https://www.crystallography.net/7231977.html