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Information card for entry 4129689
Preview
| Coordinates | 4129689.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C40 H57 Fe N3 |
|---|---|
| Calculated formula | C40 H57 Fe N3 |
| Title of publication | Three-coordinate iron(IV) bisimido complexes with aminocarbene ligation: synthesis, structure, and reactivity. |
| Authors of publication | Wang, Lei; Hu, Lianrui; Zhang, Hezhong; Chen, Hui; Deng, Liang |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2015 |
| Journal volume | 137 |
| Journal issue | 44 |
| Pages of publication | 14196 - 14207 |
| a | 10.8742 ± 0.0008 Å |
| b | 30.161 ± 0.002 Å |
| c | 11.4324 ± 0.0008 Å |
| α | 90° |
| β | 108.326 ± 0.001° |
| γ | 90° |
| Cell volume | 3559.4 ± 0.4 Å3 |
| Cell temperature | 130 K |
| Ambient diffraction temperature | 130 K |
| Number of distinct elements | 4 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.075 |
| Residual factor for significantly intense reflections | 0.0468 |
| Weighted residual factors for significantly intense reflections | 0.1031 |
| Weighted residual factors for all reflections included in the refinement | 0.1141 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.019 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 240361 (current) | 2019-11-25 | cif/ Adding structures of 4129687, 4129688, 4129689, 4129690, 4129691, 4129692 via cif-deposit CGI script. |
4129689.cif |
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Users of the data should acknowledge the original authors of the
structural data.