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Information card for entry 7707742
Preview
Coordinates | 7707742.cif |
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Original paper (by DOI) | HTML |
Common name | tris(1-nitratoethyl-5H-tetrazole) dinitrato copper(II) |
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Chemical name | tris(1-nitratoethyl-5H-tetrazole) dinitrato copper(II) |
Formula | C9 H15 Cu N17 O15 |
Calculated formula | C9 H15 Cu N17 O15 |
Title of publication | Nitratoethyl-5H-tetrazoles: improving the oxygen balance through application of organic nitrates in energetic coordination compounds. |
Authors of publication | Gruhne, Michael S.; Lenz, Tobias; Rösch, Markus; Lommel, Marcus; Wurzenberger, Maximilian H. H.; Klapötke, Thomas M; Stierstorfer, Jörg |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2021 |
Journal volume | 50 |
Journal issue | 31 |
Pages of publication | 10811 - 10825 |
a | 20.6706 ± 0.0013 Å |
b | 7.2984 ± 0.0004 Å |
c | 16.4791 ± 0.0009 Å |
α | 90° |
β | 109.752 ± 0.007° |
γ | 90° |
Cell volume | 2339.8 ± 0.3 Å3 |
Cell temperature | 99 K |
Ambient diffraction temperature | 99 K |
Number of distinct elements | 5 |
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 | 0.0713 |
Residual factor for significantly intense reflections | 0.0442 |
Weighted residual factors for significantly intense reflections | 0.0797 |
Weighted residual factors for all reflections included in the refinement | 0.0916 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.02 |
Diffraction radiation probe | x-ray |
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/7707742.html
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Users of the data should acknowledge the original authors of the
structural data.