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Information card for entry 4116386
Preview
| Coordinates | 4116386.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | Trichloroniumhexafluoroarsenate |
|---|---|
| Formula | As Cl3 F6 |
| Calculated formula | As Cl3 F6 |
| SMILES | [As](F)(F)(F)(F)([F-])F.[Cl+](Cl)Cl |
| Title of publication | The Cl2O2+ Cation: Preparation and Structural Investigation of Cl2O2+SbF6- and Cl2O2+Sb2F11- |
| Authors of publication | Thomas Drews; Wolfram Koch; Konrad Seppelt |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 1999 |
| Journal volume | 121 |
| Pages of publication | 4379 - 4384 |
| a | 7.045 ± 0.002 Å |
| b | 11.001 ± 0.003 Å |
| c | 9.299 ± 0.004 Å |
| α | 90° |
| β | 94.42 ± 0.04° |
| γ | 90° |
| Cell volume | 718.5 ± 0.4 Å3 |
| Cell temperature | 130 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 3 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0301 |
| Residual factor for significantly intense reflections | 0.0255 |
| Weighted residual factors for significantly intense reflections | 0.0611 |
| Weighted residual factors for all reflections included in the refinement | 0.0634 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.118 |
| Diffraction radiation wavelength | 0.71069 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
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