Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7010618
Preview
| Coordinates | 7010618.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | Tetraiodophosphonium tetrachloroaluminate |
|---|---|
| Formula | Al Cl4 I4 P |
| Calculated formula | Al Cl4 I4 P |
| Title of publication | Characterisation of the tetrahalophosphonium cations PBrnI4 − n+ (0 ≤ n ≤ 4) by 31P MAS NMR, IR and Raman spectroscopy and the crystal structures of PI4+AlCl4−, PI4+AlBr4− and PI4+GaI4− |
| Authors of publication | Christoph Aubauer; Martin Kaupp; Thomas M. Klapötke; Heinrich Nöth; Holger Piotrowski; Wolfgang Schnick; Jürgen Senker; Max Suter |
| Journal of publication | J. Chem. Soc., Dalton Trans. |
| Year of publication | 2001 |
| Journal issue | 12 |
| Pages of publication | 1880 - 1889 |
| a | 6.523 ± 0.006 Å |
| b | 15.808 ± 0.014 Å |
| c | 14.339 ± 0.013 Å |
| α | 90° |
| β | 92.092 ± 0.014° |
| γ | 90° |
| Cell volume | 1478 ± 2 Å3 |
| Cell temperature | 193 ± 2 K |
| Ambient diffraction temperature | 193 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0613 |
| Residual factor for significantly intense reflections | 0.044 |
| Weighted residual factors for significantly intense reflections | 0.1023 |
| Weighted residual factors for all reflections included in the refinement | 0.1099 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.053 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7010618.html
All data in the COD and the database itself are dedicated to the
public domain and licensed under the
CC0
License
.
Users of the data should acknowledge the original authors of the
structural data.