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Information card for entry 4035404
Preview
| Coordinates | 4035404.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C34 H38 Cl2 N2 O2 Zn |
|---|---|
| Calculated formula | C34 H38 Cl2 N2 O2 Zn |
| Title of publication | Preparative-Scale Synthesis of Vedejs Chiral DMAP Catalysts. |
| Authors of publication | Kinens, Artis; Balkaitis, Simonas; Suna, Edgars |
| Journal of publication | The Journal of organic chemistry |
| Year of publication | 2018 |
| Journal volume | 83 |
| Journal issue | 20 |
| Pages of publication | 12449 - 12459 |
| a | 8.8724 ± 0.0003 Å |
| b | 15.4191 ± 0.0005 Å |
| c | 11.6823 ± 0.0003 Å |
| α | 90° |
| β | 101.762 ± 0.0016° |
| γ | 90° |
| Cell volume | 1564.64 ± 0.08 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 4 |
| Hermann-Mauguin space group symbol | P 1 21 1 |
| Hall space group symbol | P 2yb |
| Residual factor for all reflections | 0.0777 |
| Residual factor for significantly intense reflections | 0.0506 |
| Weighted residual factors for significantly intense reflections | 0.0844 |
| Weighted residual factors for all reflections included in the refinement | 0.0947 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.062 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 226862 (current) | 2019-11-11 | cif/ Adding structures of 4035404 via cif-deposit CGI script. |
4035404.cif |
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Users of the data should acknowledge the original authors of the
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