Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7233387
Preview
| Coordinates | 7233387.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C22 H21 N5 O8 Zn |
|---|---|
| Calculated formula | C22 H21 N5 O8 Zn |
| Title of publication | Ligand geometry controlling Zn-MOF partial structures for their catalytic performance in Knoevenagel condensation |
| Authors of publication | He, Zimo; Zhao, Xi; Pan, Xinbo; Li, Yuanyuan; Wang, XiaoXiao; Xu, Haitao; Xu, Zhenliang |
| Journal of publication | RSC Advances |
| Year of publication | 2019 |
| Journal volume | 9 |
| Journal issue | 43 |
| Pages of publication | 25170 |
| a | 14.74 ± 0.03 Å |
| b | 8.444 ± 0.015 Å |
| c | 19.15 ± 0.03 Å |
| α | 90° |
| β | 106.957 ± 0.017° |
| γ | 90° |
| Cell volume | 2280 ± 7 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 | 0.0433 |
| Residual factor for significantly intense reflections | 0.0372 |
| Weighted residual factors for significantly intense reflections | 0.1466 |
| Weighted residual factors for all reflections included in the refinement | 0.1604 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.173 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 217523 (current) | 2019-08-14 | cif/ Adding structures of 7233385, 7233386, 7233387 via cif-deposit CGI script. |
7233387.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.