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Information card for entry 7018941
Preview
| Coordinates | 7018941.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C56 H46 Cl7 P3 Pd3 S3 |
|---|---|
| Calculated formula | C56 H46 Cl7 P3 Pd3 S3 |
| SMILES | [Pd]123[S]([Pd]4(Cl)[S]([Pd](Cl)(Cl)[S]1c1c([P]3(c3ccccc3)c3ccccc3)cccc1)c1c([P]4(c3ccccc3)c3ccccc3)cccc1)c1c([P]2(c2ccccc2)c2ccccc2)cccc1.ClCCl.ClCCl |
| Title of publication | Reaction of a heterotopic P,SAs ligand with group 10 metal(ii) complexes: As-S bond cleavage and the formation of two unusual trinuclear structural isomers for Pd and Pt. |
| Authors of publication | Sárosi, Imola; Hildebrand, Alexandra; Lönnecke, Peter; Silaghi-Dumitrescu, LuminiĊ£a; Hey-Hawkins, Evamarie |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2012 |
| Journal volume | 41 |
| Journal issue | 17 |
| Pages of publication | 5326 - 5333 |
| a | 17.0782 ± 0.0004 Å |
| b | 11.9468 ± 0.0003 Å |
| c | 28.354 ± 0.0007 Å |
| α | 90° |
| β | 100.312 ± 0.002° |
| γ | 90° |
| Cell volume | 5691.6 ± 0.2 Å3 |
| Cell temperature | 130 ± 2 K |
| Ambient diffraction temperature | 130 ± 2 K |
| Number of distinct elements | 6 |
| 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 | 0.1129 |
| Residual factor for significantly intense reflections | 0.0691 |
| Weighted residual factors for significantly intense reflections | 0.1048 |
| Weighted residual factors for all reflections included in the refinement | 0.1182 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.08 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179893 (current) | 2016-03-25 | cif/7/01/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/01/89. |
7018941.cif |
| 120112 | 2014-07-12 | Adding DOIs to range 7 structures. | 7018941.cif |
| 56002 | 2012-05-08 | cif/ Adding structures of 7018939, 7018940, 7018941, 7018942, 7018943 via cif-deposit CGI script. |
7018941.cif |
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Users of the data should acknowledge the original authors of the
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