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Information card for entry 7236631
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Coordinates | 7236631.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C2 H10 N12 O5 |
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Calculated formula | C2 H10 N12 O5 |
Title of publication | Synthesis of 1-(2H-tetrazol-5-yl)-5-nitraminotetrazole and its derivatives from 5-aminotetrazole and cyanogen azide: a promising strategy towards the development of C‒N linked bistetrazolate energetic materials |
Authors of publication | Wang, Binshen; Qi, Xiujuan; Zhang, Wenquan; Wang, Kangcai; Li, Wei; Zhang, Qinghua |
Journal of publication | J. Mater. Chem. A |
Year of publication | 2017 |
Journal volume | 5 |
Journal issue | 39 |
Pages of publication | 20867 |
a | 7.7628 ± 0.0008 Å |
b | 8.472 ± 0.0009 Å |
c | 8.6864 ± 0.0009 Å |
α | 96.566 ± 0.002° |
β | 99.093 ± 0.002° |
γ | 107.015 ± 0.002° |
Cell volume | 531.54 ± 0.1 Å3 |
Cell temperature | 170 K |
Ambient diffraction temperature | 170 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 | 0.041 |
Residual factor for significantly intense reflections | 0.0363 |
Weighted residual factors for significantly intense reflections | 0.1031 |
Weighted residual factors for all reflections included in the refinement | 0.1108 |
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 |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7236631.html
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Users of the data should acknowledge the original authors of the
structural data.