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Information card for entry 1519928
Preview
| Coordinates | 1519928.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C54 H62 Co N2 O4 |
|---|---|
| Calculated formula | C54 H62 Co N2 O4 |
| Title of publication | Bidirectional photoswitching of magnetic properties at room temperature: ligand-driven light-induced valence tautomerism |
| Authors of publication | Witt, Alexander; Heinemann, Frank W.; Khusniyarov, Marat M. |
| Journal of publication | Chem. Sci. |
| Year of publication | 2015 |
| Journal volume | 6 |
| Journal issue | 8 |
| Pages of publication | 4599 |
| a | 9.8997 ± 0.0009 Å |
| b | 10.812 ± 0.001 Å |
| c | 12.1278 ± 0.0011 Å |
| α | 104.002 ± 0.005° |
| β | 102.27 ± 0.005° |
| γ | 101.408 ± 0.005° |
| Cell volume | 1187.5 ± 0.2 Å3 |
| Cell temperature | 305 ± 2 K |
| Ambient diffraction temperature | 305 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0518 |
| Residual factor for significantly intense reflections | 0.0354 |
| Weighted residual factors for significantly intense reflections | 0.0825 |
| Weighted residual factors for all reflections included in the refinement | 0.0917 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.033 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176428 (current) | 2016-02-13 | Replaced deprecated COD CIF data names with their more modern alternatives. The _cod_cif_authors_sg_Hall and _cod_cif_authors_sg_H-M data items were renamed to _cod_original_sg_symbol_Hall and _cod_cif_authors_sg_H-M respectively. |
1519928.cif |
| 153080 | 2015-08-08 | cif/ Updating files of 1519926, 1519927, 1519928, 1519929 Original log message: Adding full bibliography for 1519926--1519929.cif. |
1519928.cif |
| 137270 | 2015-05-23 | cif/ Adding structures of 1519926, 1519927, 1519928, 1519929 via cif-deposit CGI script. |
1519928.cif |
All data in the COD and the database itself are dedicated to the
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CC0
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.
Users of the data should acknowledge the original authors of the
structural data.