Information card for entry 2022105
| Chemical name |
2,3,5,6-Tetrafluoro-1,4-diiodobenzene dimethyl sulfoxide |
| Formula |
C8 H6 F4 I2 O S |
| Calculated formula |
C8 H6 F4 I2 O S |
| Title of publication |
Polymorphism and phase transformation in the dimethyl sulfoxide solvate of 2,3,5,6-tetrafluoro-1,4-diiodobenzene |
| Authors of publication |
Bond, Andrew D.; Truscott, Chris L. |
| Journal of publication |
Acta Crystallographica Section C |
| Year of publication |
2020 |
| Journal volume |
76 |
| Journal issue |
5 |
| Pages of publication |
524 - 529 |
| a |
10.6731 ± 0.0002 Å |
| b |
18.0023 ± 0.0005 Å |
| c |
6.547 ± 0.0002 Å |
| α |
90° |
| β |
90° |
| γ |
90° |
| Cell volume |
1257.94 ± 0.06 Å3 |
| Cell temperature |
120 ± 2 K |
| Ambient diffraction temperature |
120 ± 2 K |
| Number of distinct elements |
6 |
| Space group number |
19 |
| Hall space group symbol |
P 2ac 2ab (x,y,z+1/4) |
| Residual factor for all reflections |
0.0722 |
| Residual factor for significantly intense reflections |
0.0428 |
| Weighted residual factors for significantly intense reflections |
0.0698 |
| Weighted residual factors for all reflections included in the refinement |
0.0775 |
| Goodness-of-fit parameter for all reflections included in the refinement |
0.99 |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
Yes |
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https://www.crystallography.net/2022105.html
