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Information card for entry 7130272
Preview
| Coordinates | 7130272.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C13 H14 F6 N O2 P Ru |
|---|---|
| Calculated formula | C13 H14 F6 N O2 P Ru |
| Title of publication | Enolate SNAr of unactivated arenes via [(η6-arene)RuCp]+ intermediates |
| Authors of publication | Williams, Luke J.; Bhonoah, Yunas; Walton, James W. |
| Journal of publication | Chemical Communications |
| Year of publication | 2022 |
| a | 16.7069 ± 0.0007 Å |
| b | 14.2729 ± 0.0006 Å |
| c | 14.1391 ± 0.0006 Å |
| α | 90° |
| β | 112.203 ± 0.001° |
| γ | 90° |
| Cell volume | 3121.6 ± 0.2 Å3 |
| Cell temperature | 120 K |
| Ambient diffraction temperature | 120 K |
| Number of distinct elements | 7 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0293 |
| Residual factor for significantly intense reflections | 0.0249 |
| Weighted residual factors for significantly intense reflections | 0.0572 |
| Weighted residual factors for all reflections included in the refinement | 0.0593 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.046 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 276195 (current) | 2022-06-24 | cif/ Adding structures of 7130268, 7130269, 7130270, 7130271, 7130272, 7130273, 7130274 via cif-deposit CGI script. |
7130272.cif |
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Users of the data should acknowledge the original authors of the
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