Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7245308
Preview
| Coordinates | 7245308.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | SQNU-22 |
|---|---|
| Formula | C68 H94 F2 Mg5 N10 O24 |
| Calculated formula | C48 H52 F2 Mg5 N4 O20 |
| Title of publication | An unusual F-bridged dual-trinuclear Mg-organic framework as luminescent thermometer for highly efficient low-temperature detection |
| Authors of publication | Zhang, Jian-Wei; Li, Xi; Yu, Rui-Ying; Zhang, Jinping; Chen, Ya; Li, Jieqiong |
| Journal of publication | CrystEngComm |
| Year of publication | 2022 |
| a | 16.7917 ± 0.0008 Å |
| b | 15.9499 ± 0.0008 Å |
| c | 24.5755 ± 0.0013 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 6582 ± 0.6 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 64 |
| Hermann-Mauguin space group symbol | C m c e |
| Hall space group symbol | -C 2ac 2 |
| Residual factor for all reflections | 0.0725 |
| Residual factor for significantly intense reflections | 0.0522 |
| Weighted residual factors for significantly intense reflections | 0.1372 |
| Weighted residual factors for all reflections included in the refinement | 0.1471 |
| 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 | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 277240 (current) | 2022-08-14 | cif/ Adding structures of 7245308 via cif-deposit CGI script. |
7245308.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.