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Information card for entry 4350689
Preview
| Coordinates | 4350689.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C46 H64 F24 Fe2 N12 P8 |
|---|---|
| Calculated formula | C46 H64 F24 Fe2 N12 P8 |
| Title of publication | Making oxidation potentials predictable: coordination of additives applied to the electronic fine tuning of an iron(II) complex. |
| Authors of publication | Haslinger, Stefan; Kück, Jens W; Hahn, Eva M.; Cokoja, Mirza; Pöthig, Alexander; Basset, Jean-Marie; Kühn, Fritz E |
| Journal of publication | Inorganic chemistry |
| Year of publication | 2014 |
| Journal volume | 53 |
| Journal issue | 21 |
| Pages of publication | 11573 - 11583 |
| a | 10.175 ± 0.002 Å |
| b | 18.176 ± 0.004 Å |
| c | 18.604 ± 0.005 Å |
| α | 88.663 ± 0.01° |
| β | 75.247 ± 0.01° |
| γ | 75.812 ± 0.01° |
| Cell volume | 3222.9 ± 1.3 Å3 |
| Cell temperature | 123 K |
| Ambient diffraction temperature | 123 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0379 |
| Residual factor for significantly intense reflections | 0.0321 |
| Weighted residual factors for significantly intense reflections | 0.0742 |
| Weighted residual factors for all reflections included in the refinement | 0.0775 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.038 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 239987 (current) | 2019-11-25 | cif/ Adding structures of 4350689, 4350690, 4350691, 4350692 via cif-deposit CGI script. |
4350689.cif |
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Users of the data should acknowledge the original authors of the
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