Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7027674
Preview
| Coordinates | 7027674.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C12 H36 Cu2 N8 O10 |
|---|---|
| Calculated formula | C12 H36 Cu2 N8 O10 |
| Title of publication | Dimerization of a copper(II) compound with a tetradentate diaminodiamide ligand † |
| Authors of publication | Comba, Peter; Gavrish, Sergey P.; Lampeka, Yaroslaw D.; Lightfoot, Philip; Peters, Alexander |
| Journal of publication | Journal of the Chemical Society, Dalton Transactions |
| Year of publication | 1999 |
| Journal issue | 22 |
| Pages of publication | 4099 |
| a | 10.977 ± 0.005 Å |
| b | 15.243 ± 0.004 Å |
| c | 13.878 ± 0.004 Å |
| α | 90° |
| β | 100.53 ± 0.03° |
| γ | 90° |
| Cell volume | 2283 ± 1.4 Å3 |
| Cell temperature | 293.2 K |
| Ambient diffraction temperature | 293.2 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for significantly intense reflections | 0.0456 |
| Weighted residual factors for significantly intense reflections | 0.0438 |
| Goodness-of-fit parameter for significantly intense reflections | 3.527 |
| Diffraction radiation wavelength | 0.7107 Å |
| Diffraction radiation type | MoKalpha |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301848 (current) | 2025-08-21 | Add cross-references to PubChem compounds in COD range 7/02/ Each referenced PubChem compound corresponds to the full crystal structure. |
7027674.cif |
| 176453 | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7. |
7027674.cif |
| 95636 | 2014-01-28 | cif/ Adding structures of 7027673, 7027674 via cif-deposit CGI script. |
7027674.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.