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Information card for entry 7250822
Preview
| Coordinates | 7250822.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | ((2S,3S)or(2R,3R),E)-2-methyl-2,3,5-triphenylpent-4-enenitrile |
|---|---|
| Formula | C24 H21 N |
| Calculated formula | C24 H21 N |
| Title of publication | Cu/Pd dual catalyzed stereoselective construction of vicinal tri- and tetrasubstituted stereocenters connected to chiral α-arylacetonitriles |
| Authors of publication | Mimoun, Liliane; Sanaa, Hamdi; Heppner, Florian; Gérard, Hélène; Réset, Laurine; West, Caroline; Vanthuyne, Nicolas; Retailleau, Pascal; Nicolas, Cyril; Gillaizeau, Isabelle |
| Journal of publication | RSC Advances |
| Year of publication | 2025 |
| Journal volume | 15 |
| Journal issue | 37 |
| Pages of publication | 30915 - 30920 |
| a | 11.5532 ± 0.0009 Å |
| b | 6.4625 ± 0.0004 Å |
| c | 13.2348 ± 0.001 Å |
| α | 90° |
| β | 107.991 ± 0.008° |
| γ | 90° |
| Cell volume | 939.83 ± 0.12 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 3 |
| Space group number | 4 |
| Hermann-Mauguin space group symbol | P 1 21 1 |
| Hall space group symbol | P 2yb |
| Residual factor for all reflections | 0.0378 |
| Residual factor for significantly intense reflections | 0.0244 |
| Weighted residual factors for significantly intense reflections | 0.043 |
| Weighted residual factors for all reflections included in the refinement | 0.0459 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.1136 |
| 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 |
|---|---|---|---|
| 301946 (current) | 2025-08-30 | cif/ Adding structures of 7250821, 7250822, 7250823, 7250824, 7250825 via cif-deposit CGI script. |
7250822.cif |
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Users of the data should acknowledge the original authors of the
structural data.