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Information card for entry 4518582
Preview
| Coordinates | 4518582.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C21 H21 N O |
|---|---|
| Calculated formula | C21 H21 N O |
| Title of publication | Silyl Radical-Mediated Carbocyclization of Acrylamide-/Vinyl Sulfonamide-Attached Alkylidenecyclopropanes via Photoredox Catalysis with a Catalytic Amount of Silane Reagent |
| Authors of publication | Zhang, Xiao-Yu; Wu, Xiao-Yun; Zhang, Bo; Wei, Yin; Shi, Min |
| Journal of publication | ACS Catalysis |
| Year of publication | 2021 |
| Pages of publication | 4372 - 4380 |
| a | 7.4865 ± 0.0002 Å |
| b | 7.4865 ± 0.0002 Å |
| c | 59.274 ± 0.0019 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 3322.17 ± 0.16 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 92 |
| Hermann-Mauguin space group symbol | P 41 21 2 |
| Hall space group symbol | P 4abw 2nw |
| Residual factor for all reflections | 0.0786 |
| Residual factor for significantly intense reflections | 0.0684 |
| Weighted residual factors for significantly intense reflections | 0.175 |
| Weighted residual factors for all reflections included in the refinement | 0.1823 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.098 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 263327 (current) | 2021-03-26 | cif/ Adding structures of 4518582 via cif-deposit CGI script. |
4518582.cif |
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Users of the data should acknowledge the original authors of the
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