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Information card for entry 7112167
Preview
| Coordinates | 7112167.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C38 H44 N4 O3 S Zn |
|---|---|
| Calculated formula | C38 H44 N4 O3 S Zn |
| Title of publication | Highly enantioselective hydroamination to six-membered rings by heterobimetallic catalysts |
| Authors of publication | Lenard Hussein; Nibadita Purkait; Mustafa Biyikal; Eugenia Tausch; Peter W. Roesky; Siegfried Blechert |
| Journal of publication | Chem.Commun. |
| Year of publication | 2014 |
| Journal volume | 50 |
| Pages of publication | 3862 |
| a | 8.1989 ± 0.0006 Å |
| b | 11.609 ± 0.0007 Å |
| c | 36.4888 ± 0.0022 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 3473 ± 0.4 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100 K |
| Number of distinct elements | 6 |
| Space group number | 19 |
| Hermann-Mauguin space group symbol | P 21 21 21 |
| Hall space group symbol | P 2ac 2ab |
| Residual factor for all reflections | 0.1339 |
| Residual factor for significantly intense reflections | 0.0657 |
| Weighted residual factors for significantly intense reflections | 0.123 |
| Weighted residual factors for all reflections included in the refinement | 0.1418 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.806 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
Version history
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Users of the data should acknowledge the original authors of the
structural data.