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Information card for entry 4132067
Preview
| Coordinates | 4132067.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C41.01 H60.01 Fe P Si |
|---|---|
| Calculated formula | C41 H60 Fe P Si |
| Title of publication | Base-Free Iron Hydrosilylene Complexes via an α-Hydride Migration that Induces Spin Pairing. |
| Authors of publication | Smith, Patrick W.; Tilley, T. Don |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2018 |
| Journal volume | 140 |
| Journal issue | 11 |
| Pages of publication | 3880 - 3883 |
| a | 27.887 ± 0.003 Å |
| b | 11.5982 ± 0.0013 Å |
| c | 11.5654 ± 0.001 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 3740.7 ± 0.7 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 99.99 K |
| Number of distinct elements | 5 |
| Space group number | 62 |
| Hermann-Mauguin space group symbol | P n m a |
| Hall space group symbol | -P 2ac 2n |
| Residual factor for all reflections | 0.1106 |
| Residual factor for significantly intense reflections | 0.0657 |
| Weighted residual factors for significantly intense reflections | 0.0973 |
| Weighted residual factors for all reflections included in the refinement | 0.1075 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.13 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 242109 (current) | 2019-11-25 | cif/ Adding structures of 4132067 via cif-deposit CGI script. |
4132067.cif |
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