Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4030434
Preview
| Coordinates | 4030434.cif |
|---|
| Formula | F12 H I2 K |
|---|---|
| Calculated formula | F12 H I2 K |
| SMILES | [I](F)(F)(F)(F)F.[K+].F[H]F.F[I](F)(F)(F)F |
| Title of publication | Iodine pentafluoride-hydrogen fluoride co-crystallisates, directed weak interactions |
| Authors of publication | Mahjoub, A.R.; Leopold, D.; Seppelt, K. |
| Journal of publication | European Journal of Solid State and Inorganic Chemistry |
| Year of publication | 1992 |
| Journal volume | 29 |
| Pages of publication | 635 - 647 |
| a | 9.706 ± 0.004 Å |
| b | 9.706 ± 0.004 Å |
| c | 10.548 ± 0.004 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 993.7 ± 0.7 Å3 |
| Ambient diffraction temperature | 113 K |
| Number of distinct elements | 4 |
| Space group number | 140 |
| Hermann-Mauguin space group symbol | I 4/m c m |
| Hall space group symbol | -I 4 2c |
| Residual factor for significantly intense reflections | 0.025 |
| Weighted residual factors for significantly intense reflections | 0.025 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71069 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176467 (current) | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4. |
4030434.cif |
| 129469 | 2015-01-08 | cif/ Adding structures of 4030434 via cif-deposit CGI script. |
4030434.cif |
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.