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Information card for entry 4132440
Preview
| Coordinates | 4132440.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C14 H24 Cl4 Fe N2 O4 |
|---|---|
| Calculated formula | C14 H24 Cl4 Fe N2 O4 |
| Title of publication | A Ferric Semiquinoid Single-Chain Magnet via Thermally-Switchable Metal-Ligand Electron Transfer. |
| Authors of publication | DeGayner, Jordan A.; Wang, Kunyu; Harris, T. David |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2018 |
| Journal volume | 140 |
| Journal issue | 21 |
| Pages of publication | 6550 - 6553 |
| a | 16.183 ± 0.003 Å |
| b | 9.4935 ± 0.0016 Å |
| c | 13.961 ± 0.002 Å |
| α | 90° |
| β | 104.871 ± 0.01° |
| γ | 90° |
| Cell volume | 2073 ± 0.6 Å3 |
| Cell temperature | 250 K |
| Ambient diffraction temperature | 250.08 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 | 0.0946 |
| Residual factor for significantly intense reflections | 0.0727 |
| Weighted residual factors for significantly intense reflections | 0.1927 |
| Weighted residual factors for all reflections included in the refinement | 0.2055 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.032 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 242424 (current) | 2019-11-26 | cif/ Adding structures of 4132440, 4132441 via cif-deposit CGI script. |
4132440.cif |
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