Information card for entry 7248932
Formula |
C3 H8 N8 O |
Calculated formula |
C3 H8 N8 O |
Title of publication |
Constructing layered structure amidine-based pentazolate salts with low sensitivity |
Authors of publication |
Wang, Pengfei; Liu, Lile; Sun, Zebang; Qin, Feng; Shi, Lei; Gao, Chao; Du, Yang; Zhang, Chong; Hu, Bingcheng; Sun, Chengguo |
Journal of publication |
CrystEngComm |
Year of publication |
2024 |
Journal volume |
26 |
Journal issue |
30 |
Pages of publication |
4114 - 4120 |
a |
4.8465 ± 0.0004 Å |
b |
9.6906 ± 0.0007 Å |
c |
16.5974 ± 0.0012 Å |
α |
90° |
β |
92.765 ± 0.002° |
γ |
90° |
Cell volume |
778.6 ± 0.1 Å3 |
Cell temperature |
273.15 K |
Ambient diffraction temperature |
273.15 K |
Number of distinct elements |
4 |
Space group number |
14 |
Hermann-Mauguin space group symbol |
P 1 21/c 1 |
Hall space group symbol |
-P 2ybc |
Residual factor for all reflections |
0.0573 |
Residual factor for significantly intense reflections |
0.0404 |
Weighted residual factors for significantly intense reflections |
0.0929 |
Weighted residual factors for all reflections included in the refinement |
0.1013 |
Goodness-of-fit parameter for all reflections included in the refinement |
1.04 |
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/7248932.html