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Information card for entry 4089170
Preview
| Coordinates | 4089170.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C21 H21 Mn N2 O2 |
|---|---|
| Calculated formula | C21 H21 Mn N2 O2 |
| Title of publication | Half-Sandwich Manganese Complexes Bearing Cp Tethered N-Heterocyclic Carbene Ligands: Synthesis and Mechanistic Insights into the Catalytic Ketone Hydrosilylation |
| Authors of publication | Valyaev, Dmitry A.; Wei, Duo; Elangovan, Saravanakumar; Cavailles, Matthieu; Dorcet, Vincent; Sortais, Jean-Baptiste; Darcel, Christophe; Lugan, Noël |
| Journal of publication | Organometallics |
| Year of publication | 2016 |
| Journal volume | 35 |
| Journal issue | 24 |
| Pages of publication | 4090 |
| a | 11.5849 ± 0.0007 Å |
| b | 12.3559 ± 0.0007 Å |
| c | 12.3781 ± 0.0007 Å |
| α | 90° |
| β | 94.879 ± 0.002° |
| γ | 90° |
| Cell volume | 1765.4 ± 0.18 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 5 |
| 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 | 0.026 |
| Residual factor for significantly intense reflections | 0.0248 |
| Weighted residual factors for significantly intense reflections | 0.0659 |
| Weighted residual factors for all reflections included in the refinement | 0.0671 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.051 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 238013 (current) | 2019-11-24 | cif/ Adding structures of 4089169, 4089170, 4089171 via cif-deposit CGI script. |
4089170.cif |
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Users of the data should acknowledge the original authors of the
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