Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7043308
Preview
| Coordinates | 7043308.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | compound 1 |
|---|---|
| Formula | C38 H26 Co2 N2 O9 Si |
| Calculated formula | C38 H26.08 Co2 N2 O9 Si |
| Title of publication | Theoretical and experimental studies on three water-stable, isostructural, paddlewheel based semiconducting metal‒organic frameworks |
| Authors of publication | Yang, Xiaowei; Zhang, Yuan; Li, Feng; Guo, Tiantian; Wu, Yong; Jin, Fengyan; Fang, Min; Lan, Yaqian; Li, Yafei; Zhou, Yong; Zou, Zhigang |
| Journal of publication | Dalton Trans. |
| Year of publication | 2017 |
| a | 9.7078 ± 0.0003 Å |
| b | 9.7078 ± 0.0003 Å |
| c | 21.7592 ± 0.0015 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2050.62 ± 0.17 Å3 |
| Cell temperature | 291 ± 2 K |
| Ambient diffraction temperature | 291 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 132 |
| Hermann-Mauguin space group symbol | P 42/m c m |
| Hall space group symbol | -P 4c 2c |
| Residual factor for all reflections | 0.0538 |
| Residual factor for significantly intense reflections | 0.047 |
| Weighted residual factors for significantly intense reflections | 0.1628 |
| Weighted residual factors for all reflections included in the refinement | 0.1671 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.042 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 197789 (current) | 2017-06-14 | cif/ Adding structures of 7043307, 7043308, 7043309 via cif-deposit CGI script. |
7043308.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.