Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7234312
Preview
| Coordinates | 7234312.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C26 H26 Cl2 Cu2 N4 O6 |
|---|---|
| Calculated formula | C26 H26 Cl2 Cu2 N4 O6 |
| Title of publication | Chloranilate bridged dinuclear copper(II) complexes: Syn-anti geometry tuned by steric factor and supramolecular interactions |
| Authors of publication | Kar, Paramita; Franconetti, Antonio; Ghosh, Ashutosh; Frontera, Antonio |
| Journal of publication | CrystEngComm |
| Year of publication | 2019 |
| a | 15.9212 ± 0.001 Å |
| b | 10.6452 ± 0.0006 Å |
| c | 17.4129 ± 0.001 Å |
| α | 90° |
| β | 111.849 ± 0.001° |
| γ | 90° |
| Cell volume | 2739.2 ± 0.3 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293.24 K |
| Number of distinct elements | 6 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0666 |
| Residual factor for significantly intense reflections | 0.0547 |
| Weighted residual factors for significantly intense reflections | 0.1569 |
| Weighted residual factors for all reflections included in the refinement | 0.1648 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.12 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301866 (current) | 2025-08-23 | Add cross-references to PubChem compounds in COD range 7/23/ Each referenced PubChem compound corresponds to the full crystal structure. |
7234312.cif |
| 219051 | 2019-10-03 | cif/ Adding structures of 7234310, 7234311, 7234312, 7234313 via cif-deposit CGI script. |
7234312.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.