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Information card for entry 4124383
Preview
| Coordinates | 4124383.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C52 H74 Co3 N6 |
|---|---|
| Calculated formula | C45 H65.97 Co2.975 N6 |
| Title of publication | Reactivity of Hydride Bridges in High-Spin [3M-3(μ-H)] Clusters (M = Fe(II), Co(II)). |
| Authors of publication | Lee, Yousoon; Anderton, Kevin J.; Sloane, Forrest T.; Ermert, David M.; Abboud, Khalil A.; García-Serres, Ricardo; Murray, Leslie J. |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2015 |
| Pages of publication | 150817071736007 |
| a | 20.6868 ± 0.0016 Å |
| b | 11.4465 ± 0.0009 Å |
| c | 22.04 ± 0.002 Å |
| α | 90° |
| β | 112.338 ± 0.0012° |
| γ | 90° |
| Cell volume | 4827.2 ± 0.7 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 9 |
| Hermann-Mauguin space group symbol | C 1 c 1 |
| Hall space group symbol | C -2yc |
| Residual factor for all reflections | 0.0318 |
| Residual factor for significantly intense reflections | 0.0292 |
| Weighted residual factors for significantly intense reflections | 0.0735 |
| Weighted residual factors for all reflections included in the refinement | 0.0743 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.022 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 154273 (current) | 2015-09-04 | cif/ Adding structures of 4124383 via cif-deposit CGI script. |
4124383.cif |
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