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Information card for entry 7231231
Preview
| Coordinates | 7231231.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C68 H68 Cl7 F6 N8 O4 P Pd2 |
|---|---|
| Calculated formula | C68 H68 Cl7 F6 N8 O4 P Pd2 |
| Title of publication | An efficient class of bis-NHC salts: applications in Pd-catalyzed reactions under mild reaction conditions |
| Authors of publication | Chiu, Chien-Cheng; Chiu, Hui-Tzu; Lee, Dong-Sheng; Lu, Ta-Jung |
| Journal of publication | RSC Advances |
| Year of publication | 2018 |
| Journal volume | 8 |
| Journal issue | 46 |
| Pages of publication | 26407 |
| a | 12.6608 ± 0.001 Å |
| b | 17.192 ± 0.0014 Å |
| c | 18.8963 ± 0.0015 Å |
| α | 87.943 ± 0.003° |
| β | 84.738 ± 0.003° |
| γ | 76.841 ± 0.003° |
| Cell volume | 3987.7 ± 0.6 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 8 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1375 |
| Residual factor for significantly intense reflections | 0.1096 |
| Weighted residual factors for significantly intense reflections | 0.283 |
| Weighted residual factors for all reflections included in the refinement | 0.3036 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.067 |
| 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 |
|---|---|---|---|
| 209230 (current) | 2018-07-24 | cif/ Adding structures of 7231230, 7231231 via cif-deposit CGI script. |
7231231.cif |
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Users of the data should acknowledge the original authors of the
structural data.