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Information card for entry 7248066
Preview
Coordinates | 7248066.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C12 H16 Cu N10 O6 |
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Calculated formula | C12 H16 Cu N10 O6 |
Title of publication | Synthesis of energetic coordination compounds based on pyrazole and 4-chloropyrazole via co-melting crystallization method |
Authors of publication | Lu, Zu-Jia; Wang, Ting-Wei; Sun, Mou; Xu, Mei-Qi; Zhang, Chao; Yi, Zhen-Xin; Zhang, Jian-Guo |
Journal of publication | CrystEngComm |
Year of publication | 2024 |
Journal volume | 26 |
Journal issue | 8 |
Pages of publication | 1178 - 1188 |
a | 13.6445 ± 0.0013 Å |
b | 9.875 ± 0.0009 Å |
c | 14.6405 ± 0.0014 Å |
α | 90° |
β | 112.024 ± 0.005° |
γ | 90° |
Cell volume | 1828.7 ± 0.3 Å3 |
Cell temperature | 298 K |
Ambient diffraction temperature | 298 K |
Number of distinct elements | 5 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.0508 |
Residual factor for significantly intense reflections | 0.0435 |
Weighted residual factors for significantly intense reflections | 0.1197 |
Weighted residual factors for all reflections included in the refinement | 0.1251 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.077 |
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/7248066.html
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Users of the data should acknowledge the original authors of the
structural data.