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Information card for entry 4130362
Preview
| Coordinates | 4130362.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C19 H17.5 N3.5 O4.25 Pd |
|---|---|
| Calculated formula | C19 H17.5 N3.5 O4.25 Pd |
| Title of publication | Directed, Regiocontrolled Hydroamination of Unactivated Alkenes via Protodepalladation. |
| Authors of publication | Gurak, Jr, John A; Yang, Kin S.; Liu, Zhen; Engle, Keary M. |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2016 |
| Journal volume | 138 |
| Journal issue | 18 |
| Pages of publication | 5805 - 5808 |
| a | 25.733 ± 0.0012 Å |
| b | 13.3912 ± 0.0005 Å |
| c | 21.1443 ± 0.0009 Å |
| α | 90° |
| β | 94.874 ± 0.001° |
| γ | 90° |
| Cell volume | 7259.9 ± 0.5 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100 K |
| Number of distinct elements | 5 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0513 |
| Residual factor for significantly intense reflections | 0.0378 |
| Weighted residual factors for significantly intense reflections | 0.0868 |
| Weighted residual factors for all reflections included in the refinement | 0.0955 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.027 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 240822 (current) | 2019-11-25 | cif/ Adding structures of 4130362 via cif-deposit CGI script. |
4130362.cif |
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Users of the data should acknowledge the original authors of the
structural data.