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Information card for entry 4075520
Preview
| Coordinates | 4075520.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | ana100 |
|---|---|
| Formula | C50 H34 F10 P2 Pt |
| Calculated formula | C50 H34 F10 P2 Pt |
| SMILES | [Pt]1([P](C(=C([P]1(c1ccccc1)c1ccccc1)c1ccccc1)c1ccccc1)(C#CC(C)(C)C)c1ccccc1)(c1c(c(c(c(c1F)F)F)F)F)c1c(c(c(c(c1F)F)F)F)F |
| Title of publication | Contrasting Thermal and Photochemical Intramolecular Coupling in Alkynylphosphine Platinum(II) Complexes |
| Authors of publication | García, Ana; Gómez, Julio; Lalinde, Elena; Moreno, M. Teresa |
| Journal of publication | Organometallics |
| Year of publication | 2006 |
| Journal volume | 25 |
| Journal issue | 16 |
| Pages of publication | 3926 |
| a | 10.819 ± 0.0003 Å |
| b | 10.464 ± 0.0004 Å |
| c | 20.272 ± 0.0006 Å |
| α | 90° |
| β | 101.693 ± 0.002° |
| γ | 90° |
| Cell volume | 2247.37 ± 0.13 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 7 |
| Hermann-Mauguin space group symbol | P 1 c 1 |
| Hall space group symbol | P -2yc |
| Residual factor for all reflections | 0.0407 |
| Residual factor for significantly intense reflections | 0.0349 |
| Weighted residual factors for significantly intense reflections | 0.0788 |
| Weighted residual factors for all reflections included in the refinement | 0.0823 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.077 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
Version history
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Users of the data should acknowledge the original authors of the
structural data.