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Information card for entry 2023502
Preview
| Coordinates | 2023502.cif |
|---|---|
| Original IUCr paper | HTML |
| Formula | C42 H32 F3 I P2 Pd |
|---|---|
| Calculated formula | C42 H32 F3 I P2 Pd |
| Title of publication | Phenyl palladium(II) iodide complexes isolated after Sonogashira coupling of iodobenzenes with terminal alkynes |
| Authors of publication | Bosch, Eric |
| Journal of publication | Acta Crystallographica Section E Crystallographic Communications |
| Year of publication | 2025 |
| Journal volume | 81 |
| Journal issue | 6 |
| a | 11.6327 ± 0.0005 Å |
| b | 12.8059 ± 0.0005 Å |
| c | 23.4327 ± 0.0009 Å |
| α | 90° |
| β | 93.218 ± 0.002° |
| γ | 90° |
| Cell volume | 3485.2 ± 0.2 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100.15 K |
| Number of distinct elements | 6 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | I 1 2/a 1 |
| Hall space group symbol | -I 2ya |
| Residual factor for all reflections | 0.0223 |
| Residual factor for significantly intense reflections | 0.0214 |
| Weighted residual factors for significantly intense reflections | 0.0515 |
| Weighted residual factors for all reflections included in the refinement | 0.0522 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.0523 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 299652 (current) | 2025-05-14 | cif/ Adding structures of 2023500, 2023501, 2023502, 2023503 via cif-deposit CGI script. |
2023502.cif |
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