Information card for entry 7248935
Formula |
C2 H6 N6 O2 |
Calculated formula |
C2 H6 N6 O2 |
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 |
5.2112 ± 0.0015 Å |
b |
7.849 ± 0.002 Å |
c |
7.88 ± 0.003 Å |
α |
78.116 ± 0.009° |
β |
76.103 ± 0.01° |
γ |
73.73 ± 0.009° |
Cell volume |
297.01 ± 0.16 Å3 |
Cell temperature |
273.15 K |
Ambient diffraction temperature |
273.15 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 |
0.0346 |
Residual factor for significantly intense reflections |
0.0315 |
Weighted residual factors for significantly intense reflections |
0.0833 |
Weighted residual factors for all reflections included in the refinement |
0.0855 |
Goodness-of-fit parameter for all reflections included in the refinement |
1.08 |
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/7248935.html