Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 2243854
Preview
| Coordinates | 2243854.cif |
|---|---|
| Structure factors | 2243854.hkl |
| Original IUCr paper | HTML |
| Chemical name | Poly[(3-amino-1,2,4-triazole)(μ~3~-1<i>H</i>-benzimidazole-5,6-dicarboxylato)cobalt(II)] |
|---|---|
| Formula | C11 H8 Co N6 O4 |
| Calculated formula | C11 H8 Co N6 O4 |
| Title of publication | Synthesis and crystal structure of poly[(3-amino-1,2,4-triazole)(μ~3~-1<i>H</i>-benzimidazole-5,6-dicarboxylato)cobalt(II)] |
| Authors of publication | Zhao, Chen; Li, Yi; Xiao, Jin-Sheng; Zhang, Peng-Dan; Wu, Xue-Qian; Chen, Qiang |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2021 |
| Journal volume | 77 |
| Journal issue | 7 |
| Pages of publication | 714 - 717 |
| a | 13.3368 ± 0.0008 Å |
| b | 6.8727 ± 0.0004 Å |
| c | 13.6015 ± 0.001 Å |
| α | 90° |
| β | 103.478 ± 0.007° |
| γ | 90° |
| Cell volume | 1212.38 ± 0.14 Å3 |
| Cell temperature | 279 ± 2 K |
| Ambient diffraction temperature | 279 ± 2 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 | 0.0712 |
| Residual factor for significantly intense reflections | 0.0468 |
| Weighted residual factors for significantly intense reflections | 0.0862 |
| Weighted residual factors for all reflections included in the refinement | 0.0978 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.027 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 266481 (current) | 2021-06-16 | cif/ hkl/ Adding structures of 2243854 via cif-deposit CGI script. |
2243854.cif 2243854.hkl |
All data in the COD and the database itself are dedicated to the
public domain and licensed under the
CC0
License
.
Users of the data should acknowledge the original authors of the
structural data.