Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7241187
Preview
| Coordinates | 7241187.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C29 H26 N2 O16 Zn3 |
|---|---|
| Calculated formula | C29 H26 N2 O16 Zn3 |
| Title of publication | Crystal engineering of coordination-polymer-based iodine absorbents using π-electron-rich polycarboxylate aryl ether ligand |
| Authors of publication | Chen, Junling; Li, Bo; Shi, Zhen-Zhen; He, Cheng; Duan, Chunying; Zhang, Tiexin; Wang, Liya |
| Journal of publication | CrystEngComm |
| Year of publication | 2020 |
| a | 12.8756 ± 0.0006 Å |
| b | 17.0258 ± 0.0007 Å |
| c | 14.8329 ± 0.0008 Å |
| α | 90° |
| β | 101.033 ± 0.005° |
| γ | 90° |
| Cell volume | 3191.5 ± 0.3 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 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 | 0.0456 |
| Residual factor for significantly intense reflections | 0.0343 |
| Weighted residual factors for significantly intense reflections | 0.0796 |
| Weighted residual factors for all reflections included in the refinement | 0.0837 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.04 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 256210 (current) | 2020-09-08 | cif/ Adding structures of 7241187, 7241188, 7241189, 7241190 via cif-deposit CGI script. |
7241187.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.