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Information card for entry 7129325
Preview
| Coordinates | 7129325.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C39 H56 Mg N2 |
|---|---|
| Calculated formula | C39 H56 Mg N2 |
| SMILES | [Mg]12345(N(C(=CC(=[N]1c1c(cccc1C(C)C)C(C)C)C)C)c1c(cccc1C(C)C)C(C)C)[c]1([c]2([c]3([c]4([c]51C)C)C)C)C |
| Title of publication | Synthesis and reactivity of heteroleptic zinc(i) complexes toward heteroallenes |
| Authors of publication | Li, Bin; Huse, Kevin; Wölper, Christoph; Schulz, Stephan |
| Journal of publication | Chemical Communications |
| Year of publication | 2021 |
| a | 9.4818 ± 0.0005 Å |
| b | 11.5578 ± 0.0006 Å |
| c | 17.0565 ± 0.0009 Å |
| α | 81.29 ± 0.003° |
| β | 78.956 ± 0.003° |
| γ | 70.278 ± 0.003° |
| Cell volume | 1719.33 ± 0.16 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0703 |
| Residual factor for significantly intense reflections | 0.0489 |
| Weighted residual factors for significantly intense reflections | 0.129 |
| Weighted residual factors for all reflections included in the refinement | 0.1422 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.033 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 270916 (current) | 2021-11-30 | cif/ Adding structures of 7129323, 7129324, 7129325, 7129326, 7129327, 7129328, 7129329, 7129330 via cif-deposit CGI script. |
7129325.cif |
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Users of the data should acknowledge the original authors of the
structural data.