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Information card for entry 4519324
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Coordinates | 4519324.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C6 H12 N12 O10 |
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Calculated formula | C6 H12 N12 O10 |
Title of publication | Polynitro-Functionalized Azopyrazole with High Performance and Low Sensitivity as Novel Energetic Materials. |
Authors of publication | Zhang, Guojie; Yi, Zhenxin; Cheng, Guangbin; Yang, Wei; Yang, Hongwei |
Journal of publication | ACS applied materials & interfaces |
Year of publication | 2022 |
Journal volume | 14 |
Journal issue | 8 |
Pages of publication | 10594 - 10604 |
a | 7.1996 ± 0.0007 Å |
b | 10.1924 ± 0.001 Å |
c | 11.2601 ± 0.0011 Å |
α | 101.457 ± 0.003° |
β | 92.636 ± 0.003° |
γ | 99.304 ± 0.003° |
Cell volume | 796.55 ± 0.14 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 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 | 0.1825 |
Residual factor for significantly intense reflections | 0.0862 |
Weighted residual factors for significantly intense reflections | 0.1728 |
Weighted residual factors for all reflections included in the refinement | 0.2015 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.059 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4519324.html
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Users of the data should acknowledge the original authors of the
structural data.