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Information card for entry 2241143
Preview
| Coordinates | 2241143.cif |
|---|---|
| Structure factors | 2241143.hkl |
| Original IUCr paper | HTML |
| Chemical name | Dichlorido[2-(diphenylphosphanyl)-3,4,5,6-tetrafluorobenzene-1-thiolato-κ^2^<i>P</i>,<i>S</i>]gold(III) |
|---|---|
| Formula | C18 H10 Au Cl2 F4 P S |
| Calculated formula | C18 H10 Au Cl2 F4 P S |
| SMILES | [P]1([Au](Sc2c1c(F)c(c(c2F)F)F)(Cl)Cl)(c1ccccc1)c1ccccc1 |
| Title of publication | Crystal structure of dichlorido[2-(diphenylphosphanyl)-3,4,5,6-tetrafluorobenzene-1-thiolato-κ^2^<i>P</i>,<i>S</i>]gold(III) |
| Authors of publication | Corfield, Peter W. R.; Bailey, Mary |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2015 |
| Journal volume | 71 |
| Journal issue | 10 |
| Pages of publication | m181 - m182 |
| a | 18.9 ± 0.02 Å |
| b | 8.388 ± 0.012 Å |
| c | 24.15 ± 0.03 Å |
| α | 90° |
| β | 100.75 ± 0.03° |
| γ | 90° |
| Cell volume | 3761 ± 8 Å3 |
| Cell temperature | 298 ± 2 K |
| Ambient diffraction temperature | 298 ± 2 K |
| Number of distinct elements | 7 |
| 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 | 0.0547 |
| Residual factor for significantly intense reflections | 0.0317 |
| Weighted residual factors for significantly intense reflections | 0.0742 |
| Weighted residual factors for all reflections included in the refinement | 0.086 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.025 |
| Diffraction radiation wavelength | 0.7107 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181912 (current) | 2016-04-06 | hkl/2/24/ (antanas@echidna) Adding IUCr specific svn headers to multiple entries in subrange 2/24/11. |
2241143.cif 2241143.hkl |
| 158392 | 2015-09-26 | cif/ hkl/ Adding structures of 2241143 via cif-deposit CGI script. |
2241143.cif 2241143.hkl |
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Users of the data should acknowledge the original authors of the
structural data.