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CIF Information Card
Information card for 7151780
7151779 << 7151780 >> 7151781Preview
|
Coordinates |
7151780.cif |
Structure parameters
| Formula | - C12 H24 Cl2 I K O6 - |
| Calculated formula | - C12 H24 Cl2 I K O6 - |
| Title of publication | Iodination of anilines and phenols with 18-crown-6 supported ICl2-. |
| Authors of publication | Mbatia, Hannah W.; Ulloa, Olbelina A.; Kennedy, Daniel P.; Incarvito, Christopher D.; Burdette, Shawn C. |
| Journal of publication | Organic & biomolecular chemistry |
| Year of publication | 2011 |
| Journal volume | 9 |
| Journal issue | 8 |
| Pages of publication | 2987 - 2991 |
| a | 8.886 ± 0.0009 Å |
| b | 8.1987 ± 0.0008 Å |
| c | 13.9274 ± 0.0013 Å |
| α | 90° |
| β | 101.873 ± 0.002° |
| γ | 90° |
| Cell volume | 992.95 ± 0.17 Å3 |
| Cell temperature | 223.1 K |
| Number of distinct elements | 6 |
| Hermann-Mauguin symmetry space group | P 1 21/n 1 |
| Hall symmetry space group | -P 2yn |
| Residual factor for observed reflections | 0.0344 |
| Weighted residual factors for all reflections included in the refinement | 0.06 |
| Goodness-of-fit parameter for observed reflections | 1.124 |
| Diffraction radiation wavelength | 0.71075 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |