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Information card for entry 4518941
Preview
| Coordinates | 4518941.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | RAD-7-203 |
|---|---|
| Chemical name | (tBuXPhosAu)2ISbF6 |
| Formula | C61 H93 Au2 Cl9 F6 I P2 Sb |
| Calculated formula | C61 H93 Au2 Cl9 F6 I P2 Sb |
| Title of publication | Mechanistic Investigation into the Gold-Catalyzed Decarboxylative Cross-Coupling of Iodoarenes |
| Authors of publication | Daley, Ryan A.; Morrenzin, Aaron S.; Neufeldt, Sharon R.; Topczewski, Joseph J. |
| Journal of publication | ACS Catalysis |
| Year of publication | 2021 |
| Pages of publication | 9578 - 9587 |
| a | 15.128 ± 0.0011 Å |
| b | 17.2038 ± 0.0012 Å |
| c | 17.914 ± 0.002 Å |
| α | 111.6 ± 0.001° |
| β | 103.331 ± 0.001° |
| γ | 109.325 ± 0.001° |
| Cell volume | 3746.2 ± 0.6 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 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 | 0.0352 |
| Residual factor for significantly intense reflections | 0.0284 |
| Weighted residual factors for significantly intense reflections | 0.0664 |
| Weighted residual factors for all reflections included in the refinement | 0.0695 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.013 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 267915 (current) | 2021-08-03 | cif/ Adding structures of 4518941 via cif-deposit CGI script. |
4518941.cif |
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