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Information card for entry 4065686
Preview
Coordinates | 4065686.cif |
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Original paper (by DOI) | HTML |
Formula | C38 H26 F8 P2 Pt |
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Calculated formula | C38 H26 F8 P2 Pt |
SMILES | [Pt]1([P](CC[P]1(c1c(cccc1F)F)c1c(cccc1F)F)(c1c(cccc1F)F)c1c(cccc1F)F)(c1ccccc1)c1ccccc1 |
Title of publication | Ligand Electronic Effect on Reductive Elimination of Biphenyl fromcis-[Pt(Ph)2(diphosphine)] Complexes Bearing Electron-Poor Diphosphine: Correlation Study between Experimental and Theoretical Results |
Authors of publication | Korenaga, Toshinobu; Abe, Kayoko; Ko, Aram; Maenishi, Ryota; Sakai, Takashi |
Journal of publication | Organometallics |
Year of publication | 2010 |
Journal volume | 29 |
Journal issue | 18 |
Pages of publication | 4025 |
a | 10.2255 ± 0.0009 Å |
b | 15.0723 ± 0.0013 Å |
c | 21.8862 ± 0.0019 Å |
α | 75.815 ± 0.001° |
β | 82.332 ± 0.001° |
γ | 87.809 ± 0.001° |
Cell volume | 3241 ± 0.5 Å3 |
Cell temperature | 100 K |
Ambient diffraction temperature | 100 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0404 |
Residual factor for significantly intense reflections | 0.0335 |
Weighted residual factors for significantly intense reflections | 0.0851 |
Weighted residual factors for all reflections included in the refinement | 0.0885 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.09 |
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/4065686.html
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