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CIF Information Card
Information card for 7206020
7206019 << 7206020 >> 7206021Preview
|
Coordinates |
7206020.cif |
Structure parameters
| Formula | - C2 H3 Cu N4 - |
| Calculated formula | - C2 H3 Cu N4 - |
| Title of publication | Packing polymorphism of a two-dimensional copper(i) 3-amino-1,2,4-triazolate coordination polymer |
| Authors of publication | Chen, Da; Liu, Yi-Jiang; Lin, Yan-Yong; Zhang, Jie-Peng; Chen, Xiao-Ming |
| Journal of publication | CrystEngComm |
| Year of publication | 2011 |
| Journal volume | 13 |
| Journal issue | 11 |
| Pages of publication | 3827 |
| a | 8.4608 ± 0.0007 Å |
| b | 10.3198 ± 0.0009 Å |
| c | 10.5728 ± 0.0009 Å |
| α | 90° |
| β | 118.944 ± 0.008° |
| γ | 90° |
| Cell volume | 807.84 ± 0.13 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 4 |
| Hermann-Mauguin symmetry space group | P 1 21/c 1 |
| Hall symmetry space group | -P 2ybc |
| Residual factor for all reflections | 0.0407 |
| Residual factor for observed reflections | 0.0335 |
| Weighted residual factors for the observed reflections | 0.0863 |
| Weighted residual factors for all reflections included in the refinement | 0.0903 |
| Goodness-of-fit parameter for observed reflections | 1.042 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |