Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4125138
Preview
| Coordinates | 4125138.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C68 H50 O32 Zr6 |
|---|---|
| Calculated formula | C68 H50 O32 Zr6 |
| Title of publication | Linker Installation: Engineering Pore Environment with Precisely Placed Functionalities in Zirconium MOFs. |
| Authors of publication | Yuan, Shuai; Chen, Ying-Pin; Qin, Jun-Sheng; Lu, Weigang; Zou, Lanfang; Zhang, Qiang; Wang, Xuan; Sun, Xing; Zhou, Hong-Cai |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2016 |
| Journal volume | 138 |
| Journal issue | 28 |
| Pages of publication | 8912 - 8919 |
| a | 35.053 ± 0.017 Å |
| b | 35.053 Å |
| c | 12.665 ± 0.006 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 15562 ± 11 Å3 |
| Cell temperature | 110 ± 2 K |
| Ambient diffraction temperature | 110 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 138 |
| Hermann-Mauguin space group symbol | P 42/n c m :2 |
| Hall space group symbol | -P 4ac 2ac |
| Residual factor for all reflections | 0.144 |
| Residual factor for significantly intense reflections | 0.0616 |
| Weighted residual factors for significantly intense reflections | 0.1114 |
| Weighted residual factors for all reflections included in the refinement | 0.1247 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.003 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4125138.html
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.