Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4350823
Preview
| Coordinates | 4350823.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C10 H7 Cu2 I N6 |
|---|---|
| Calculated formula | C10 H7 Cu2 I N6 |
| Title of publication | An unprecedented (4, 8)-connected self-penetrating Cu(I)-MOF constructed from the rare [Cu4I2]2+ cationic cluster and in situ generated tetrazole ligand |
| Authors of publication | Huang, Rong-Yi; Zhu, Chang-Hai; Kong, Xue-Jun; Xu, Heng |
| Journal of publication | Inorganic Chemistry Communications |
| Year of publication | 2015 |
| Journal volume | 61 |
| Pages of publication | 1 - 4 |
| a | 8.714 ± 0.006 Å |
| b | 13.48 ± 0.01 Å |
| c | 20.447 ± 0.015 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2402 ± 3 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 61 |
| Hermann-Mauguin space group symbol | P b c a |
| Hall space group symbol | -P 2ac 2ab |
| Residual factor for all reflections | 0.0453 |
| Residual factor for significantly intense reflections | 0.035 |
| Weighted residual factors for significantly intense reflections | 0.0824 |
| Weighted residual factors for all reflections included in the refinement | 0.0867 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.006 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 294737 (current) | 2024-09-13 | cif/ Adding structures of 4350823 via cif-deposit CGI script. |
4350823.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.