Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 2239585
Preview
| Coordinates | 2239585.cif |
|---|---|
| Structure factors | 2239585.hkl |
| Original IUCr paper | HTML |
| Common name | Bis(tetraphenylphosphonium) tetrachlorocobaltate(II) |
|---|---|
| Chemical name | Bis(tetraphenylphosphonium) tetrachloridocobaltate(II) |
| Formula | C48 H40 Cl4 Co P2 |
| Calculated formula | C48 H40 Cl4 Co P2 |
| SMILES | c1(ccccc1)[P+](c1ccccc1)(c1ccccc1)c1ccccc1.Cl[Co](Cl)([Cl-])[Cl-].c1(ccccc1)[P+](c1ccccc1)(c1ccccc1)c1ccccc1 |
| Title of publication | Bis(tetraphenylphosphonium) tetrachloridocobaltate(II) |
| Authors of publication | Ouahida, Zeghouan; Hadjadj, Nasreddine; Guenifa, Fatiha; Bendjeddou, Lamia; Merazig, Hocine |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2014 |
| Journal volume | 70 |
| Journal issue | 6 |
| Pages of publication | m229 - m230 |
| a | 10.9154 ± 0.0004 Å |
| b | 19.2514 ± 0.0006 Å |
| c | 20.1826 ± 0.0007 Å |
| α | 90° |
| β | 91.008 ± 0.002° |
| γ | 90° |
| Cell volume | 4240.4 ± 0.3 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0391 |
| Residual factor for significantly intense reflections | 0.0302 |
| Weighted residual factors for all reflections included in the refinement | 0.0836 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.037 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181895 (current) | 2016-04-06 | hkl/2/23/ (antanas@echidna) Adding IUCr specific svn headers to multiple entries in subrange 2/23/95. |
2239585.cif 2239585.hkl |
| 181314 | 2016-04-03 | hkl/2/23/ (antanas@echidna) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/23/95. |
2239585.cif 2239585.hkl |
| 176798 | 2016-02-21 | cif/2/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/23. |
2239585.cif 2239585.hkl |
| 114125 | 2014-05-22 | cif/ hkl/ Adding structures of 2239585 via cif-deposit CGI script. |
2239585.cif 2239585.hkl |
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.