Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7702623
Preview
| Coordinates | 7702623.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C25 H30 Cu N4 O10 |
|---|---|
| Calculated formula | C25 H30 Cu N4 O10 |
| Title of publication | Complex-formation reactions of Cu(ii) and Zn(ii) 2,2′-bipyridine and 1,10-phenanthroline complexes with bicarbonate. Identification of different carbonate coordination modes |
| Authors of publication | Mao, Zong-Wan; Heinemann, Frank W.; Liehr, Günther; Eldik, Rudi van |
| Journal of publication | Journal of the Chemical Society, Dalton Transactions |
| Year of publication | 2001 |
| Journal issue | 24 |
| Pages of publication | 3652 |
| a | 9.901 ± 0.001 Å |
| b | 26.277 ± 0.003 Å |
| c | 10.51 ± 0.003 Å |
| α | 90° |
| β | 105.93 ± 0.02° |
| γ | 90° |
| Cell volume | 2629.4 ± 0.9 Å3 |
| Cell temperature | 200 ± 2 K |
| Ambient diffraction temperature | 200 ± 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 all reflections | 0.0752 |
| Residual factor for significantly intense reflections | 0.0533 |
| Weighted residual factors for all reflections | 0.1413 |
| Weighted residual factors for significantly intense reflections | 0.1275 |
| Goodness-of-fit parameter for all reflections | 1.016 |
| Goodness-of-fit parameter for significantly intense reflections | 1.07 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301878 (current) | 2025-08-23 | Add cross-references to PubChem compounds in COD range 7/70/ Each referenced PubChem compound corresponds to the full crystal structure. |
7702623.cif |
| 243928 | 2019-11-28 | cif/ Adding structures of 7702623, 7702624, 7702625, 7702626, 7702627 via cif-deposit CGI script. |
7702623.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.