Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4308705
Preview
| Coordinates | 4308705.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C98 H110 Ag2 F12 O24 P8 Pt2 S4 |
|---|---|
| Calculated formula | C98 H110 Ag2 F12 O24 P8 Pt2 S4 |
| SMILES | [Ag]12([O]=P(OCC)(OCC)[C@H]([P]([Pt]31([O]=P([C@@H](c1ccccc1)[P]3(c1ccccc1)c1ccccc1)(OCC)OCC)C)(c1ccccc1)c1ccccc1)c1ccccc1)[O]=S(=O)(O[Ag]1([O]=P(OCC)(OCC)[C@@H]([P]([Pt]31([O]=P([C@H](c1ccccc1)[P]3(c1ccccc1)c1ccccc1)(OCC)OCC)C)(c1ccccc1)c1ccccc1)c1ccccc1)[O]=S(O2)(=O)C(F)(F)F)C(F)(F)F.FC(S(=O)(=O)[O-])(F)F.FC(F)(F)S(=O)(=O)[O-] |
| Title of publication | Synthesis and Structure of Pt(II) Phosphonato-Phosphine Complexes and of a P,O-Stabilized Metal-Metal-Bonded Pt2Ag2 Complex |
| Authors of publication | Nicola Oberbeckmann-Winter; Xavier Morise; Pierre Braunstein; Richard Welter |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2005 |
| Journal volume | 44 |
| Pages of publication | 1391 - 1403 |
| a | 13.55 ± 0.005 Å |
| b | 14.827 ± 0.005 Å |
| c | 15.009 ± 0.005 Å |
| α | 90.958 ± 0.005° |
| β | 109.643 ± 0.005° |
| γ | 94.52 ± 0.005° |
| Cell volume | 2828.1 ± 1.7 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 8 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0711 |
| Residual factor for significantly intense reflections | 0.0499 |
| Weighted residual factors for significantly intense reflections | 0.1175 |
| Weighted residual factors for all reflections included in the refinement | 0.1381 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.124 |
| Diffraction radiation wavelength | 0.71069 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179125 (current) | 2016-03-23 | cif/4/30/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/30/87. |
4308705.cif |
| 120081 | 2014-07-12 | Adding DOIs to range 4/30 structures. | 4308705.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4308705.cif |
| 1526 | 2010-09-26 | cif/4/ Adding new CIFs from Inorg. Chem. 2005 deposited via Web deposition site to the COD test database (and transferede to the main COD database after renaming). |
4308705.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.