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Information card for entry 4035320
Preview
| Coordinates | 4035320.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C20 H18 F4 |
|---|---|
| Calculated formula | C20 H18 F4 |
| Title of publication | Ni-Catalyzed Dimerization and Hydroperfluoroarylation of 1,3-Dienes. |
| Authors of publication | Iwasaki, Takanori; Min, Xin; Fukuoka, Asuka; Zhu, Longzhi; Qiu, Renhua; Yang, Tao; Ehara, Masahiro; Sudalai, Arumugam; Kambe, Nobuaki |
| Journal of publication | The Journal of organic chemistry |
| Year of publication | 2018 |
| Journal volume | 83 |
| Journal issue | 16 |
| Pages of publication | 9267 - 9277 |
| a | 13.0228 ± 0.0004 Å |
| b | 5.7 ± 0.0002 Å |
| c | 22.0772 ± 0.0008 Å |
| α | 90° |
| β | 95.706 ± 0.0019° |
| γ | 90° |
| Cell volume | 1630.67 ± 0.1 Å3 |
| Cell temperature | 123 K |
| Ambient diffraction temperature | 123 K |
| Number of distinct elements | 3 |
| Space group number | 13 |
| Hermann-Mauguin space group symbol | P 1 2/c 1 |
| Hall space group symbol | -P 2yc |
| Residual factor for all reflections | 0.1354 |
| Residual factor for significantly intense reflections | 0.1007 |
| Weighted residual factors for significantly intense reflections | 0.2756 |
| Weighted residual factors for all reflections included in the refinement | 0.321 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.116 |
| Diffraction radiation wavelength | 1.54187 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 226784 (current) | 2019-11-11 | cif/ Adding structures of 4035320 via cif-deposit CGI script. |
4035320.cif |
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Users of the data should acknowledge the original authors of the
structural data.