Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 8104804
Preview
| Coordinates | 8104804.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C28 H34 Co N8 O8 |
|---|---|
| Calculated formula | C28 H34 Co N8 O8 |
| Title of publication | Crystal structure of catena-poly[triaqua-(μ2-1,3-di(1H-imidazol-1-yl)propane-κ2 N:N′)-(4,4′-(1H-1,2,4-triazole-3,5-diyl)dibenzoato-κ1O)cobalt(II)] — N,N′-dimethylformamide (1/1), C28H34N8O8Co |
| Authors of publication | Qiu, Ying; Zhao, Juan; Liu, Mei-Ling; Ge, Hong-Guang; Ji, Xiao-Hui; Wang, Qin; Jin, Ling-xia; Lu, Jiu-Fu |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2021 |
| Journal volume | 236 |
| Journal issue | 3 |
| Pages of publication | 697 - 699 |
| a | 14.8071 ± 0.0017 Å |
| b | 19.676 ± 0.002 Å |
| c | 10.858 ± 0.0013 Å |
| α | 90° |
| β | 104.202 ± 0.002° |
| γ | 90° |
| Cell volume | 3066.7 ± 0.6 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 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 | 0.0507 |
| Residual factor for significantly intense reflections | 0.0377 |
| Weighted residual factors for significantly intense reflections | 0.1114 |
| Weighted residual factors for all reflections included in the refinement | 0.1228 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.053 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 273804 (current) | 2022-03-18 | cif/ Adding structures of 8104804 via cif-deposit CGI script. |
8104804.cif |
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.