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Information card for entry 4126216
Preview
| Coordinates | 4126216.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C26 H26 Co K N2 O5 |
|---|---|
| Calculated formula | C26 H26 Co K N2 O5 |
| Title of publication | Ligand and Metal Based Multielectron Redox Chemistry of Cobalt Supported by Tetradentate Schiff Bases. |
| Authors of publication | Andrez, Julie; Guidal, Valentin; Scopelliti, Rosario; Pécaut, Jacques; Gambarelli, Serge; Mazzanti, Marinella |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2017 |
| Journal volume | 139 |
| Journal issue | 25 |
| Pages of publication | 8628 - 8638 |
| a | 13.0057 ± 0.0003 Å |
| b | 15.1594 ± 0.0003 Å |
| c | 12.1103 ± 0.0002 Å |
| α | 90° |
| β | 99.971 ± 0.002° |
| γ | 90° |
| Cell volume | 2351.59 ± 0.08 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 6 |
| 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 | 0.0548 |
| Residual factor for significantly intense reflections | 0.0373 |
| Weighted residual factors for significantly intense reflections | 0.0796 |
| Weighted residual factors for all reflections included in the refinement | 0.0875 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.031 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301834 (current) | 2025-08-20 | Add cross-references to PubChem compounds in COD range 4/12/ Each referenced PubChem compound corresponds to the full crystal structure. |
4126216.cif |
| 199579 | 2017-08-05 | cif/ Updating files of 4126214, 4126215, 4126216, 4126217 Original log message: Adding full bibliography for 4126214--4126217.cif. |
4126216.cif |
| 197820 | 2017-06-15 | cif/ Adding structures of 4126216 via cif-deposit CGI script. |
4126216.cif |
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Users of the data should acknowledge the original authors of the
structural data.