Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4080897
Preview
| Coordinates | 4080897.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | [(COD)Pt(CC(4F)Ph)2] |
|---|---|
| Chemical name | Bis((4-fluorophenyl)ethynyl)(1,5-cyclooctadien)platinum(II) |
| Formula | C24 H20 F2 Pt |
| Calculated formula | C24 H20 F2 Pt |
| SMILES | C(#Cc1ccc(F)cc1)[Pt]123([CH]4=[CH]2CC[CH]1=[CH]3CC4)C#Cc1ccc(F)cc1 |
| Title of publication | Strong Cytotoxicity of Organometallic Platinum Complexes with Alkynyl Ligands |
| Authors of publication | Lüning, Anna; Schur, Julia; Hamel, Laura; Ott, Ingo; Klein, Axel |
| Journal of publication | Organometallics |
| Year of publication | 2013 |
| Journal volume | 32 |
| Journal issue | 13 |
| Pages of publication | 3662 |
| a | 10.0746 ± 0.0017 Å |
| b | 7.8999 ± 0.0017 Å |
| c | 11.7544 ± 0.0017 Å |
| α | 90° |
| β | 95.684 ± 0.019° |
| γ | 90° |
| Cell volume | 930.9 ± 0.3 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 13 |
| Hermann-Mauguin space group symbol | P 1 2/c 1 |
| Hall space group symbol | -P 2yc |
| Residual factor for all reflections | 0.0654 |
| Residual factor for significantly intense reflections | 0.0339 |
| Weighted residual factors for significantly intense reflections | 0.0541 |
| Weighted residual factors for all reflections included in the refinement | 0.0594 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.863 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4080897.html
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.