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Information card for entry 7015626
Preview
| Coordinates | 7015626.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C28 H22 N6 P2 Pd S2 |
|---|---|
| Calculated formula | C28 H22 N6 P2 Pd S2 |
| SMILES | [Pd]12([P](=Nc3[n]1ncs3)(c1ccccc1)c1ccccc1)[P](=Nc1[n]2ncs1)(c1ccccc1)c1ccccc1 |
| Title of publication | Chelating or bridging Pd(ii) and Pt(ii) metalloligands from the functional phosphine ligand N-(diphenylphosphino)-1,3,4-thiadiazol-2-amine. New heterometallic Pd(ii)/Pt(ii) and Pt(ii)/Au(i) complexes. |
| Authors of publication | Zhang, Shuanming; Pattacini, Roberto; Braunstein, Pierre |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2011 |
| Journal volume | 40 |
| Journal issue | 21 |
| Pages of publication | 5711 - 5719 |
| a | 11.3926 ± 0.0004 Å |
| b | 14.0042 ± 0.0004 Å |
| c | 18.9125 ± 0.0008 Å |
| α | 99.963 ± 0.002° |
| β | 91.366 ± 0.002° |
| γ | 109.306 ± 0.002° |
| Cell volume | 2794.08 ± 0.18 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0835 |
| Residual factor for significantly intense reflections | 0.0441 |
| Weighted residual factors for significantly intense reflections | 0.0907 |
| Weighted residual factors for all reflections included in the refinement | 0.1062 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.026 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179860 (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 7/01/56. |
7015626.cif |
| 120112 | 2014-07-12 | Adding DOIs to range 7 structures. | 7015626.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7015626.cif |
| 21207 | 2011-06-21 | ../uploads/cif-deposit/cod/cif Adding structures of 7015626, 7015627, 7015628, 7015629, 7015630 via cif-deposit CGI script. |
7015626.cif |
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