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Information card for entry 7128222
Preview
| Coordinates | 7128222.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C14 H18 F6 I N2 P |
|---|---|
| Calculated formula | C14 H18 F6 I N2 P |
| Title of publication | Nucleophilic iodonium interactions (NIIs) in 2-coordinate iodine(I) and silver(I) complexes. |
| Authors of publication | Ward, Jas S.; Frontera, Antonio; Rissanen, Kari |
| Journal of publication | Chemical communications (Cambridge, England) |
| Year of publication | 2021 |
| Journal volume | 57 |
| Journal issue | 41 |
| Pages of publication | 5094 - 5097 |
| a | 11.7938 ± 0.0003 Å |
| b | 10.2841 ± 0.0002 Å |
| c | 15.1354 ± 0.0003 Å |
| α | 90° |
| β | 109.149 ± 0.002° |
| γ | 90° |
| Cell volume | 1734.18 ± 0.07 Å3 |
| Cell temperature | 120.01 ± 0.1 K |
| Ambient diffraction temperature | 120.01 ± 0.1 K |
| Number of distinct elements | 6 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0212 |
| Residual factor for significantly intense reflections | 0.021 |
| Weighted residual factors for significantly intense reflections | 0.0538 |
| Weighted residual factors for all reflections included in the refinement | 0.0542 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.085 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301860 (current) | 2025-08-22 | Add cross-references to PubChem compounds in COD range 7/12/ Each referenced PubChem compound corresponds to the full crystal structure. |
7128222.cif |
| 265853 | 2021-06-05 | cif/ Updating files of 7128218, 7128219, 7128220, 7128221, 7128222, 7128223, 7128224, 7128225 Original log message: Adding full bibliography for 7128218--7128225.cif. |
7128222.cif |
| 264378 | 2021-04-22 | cif/ Adding structures of 7128218, 7128219, 7128220, 7128221, 7128222, 7128223, 7128224, 7128225 via cif-deposit CGI script. |
7128222.cif |
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Users of the data should acknowledge the original authors of the
structural data.