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Information card for entry 4069900
Preview
Coordinates | 4069900.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C38 H25 Br Cl F5 N P Pt |
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Calculated formula | C38 H25 Br Cl F5 N P Pt |
SMILES | [Pt]1(c2cccc(c2C=[N]1Cc1ccc(Cl)cc1)c1c(F)c(F)c(F)c(F)c1F)(Br)[P](c1ccccc1)(c1ccccc1)c1ccccc1 |
Title of publication | Kinetico-Mechanistic Insight into the Platinum-Mediated C−C Coupling of Fluorinated Arenes |
Authors of publication | Calvet, Teresa; Crespo, Margarita; Font-Bardia, Mercè; Gómez, Kerman; González, Gabriel; Martínez, Manuel |
Journal of publication | Organometallics |
Year of publication | 2009 |
Journal volume | 28 |
Journal issue | 17 |
Pages of publication | 5096 |
a | 12.233 ± 0.007 Å |
b | 12.259 ± 0.005 Å |
c | 13.842 ± 0.006 Å |
α | 111.65 ± 0.03° |
β | 98.54 ± 0.03° |
γ | 109.89 ± 0.03° |
Cell volume | 1722.8 ± 1.6 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 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 | 0.0641 |
Residual factor for significantly intense reflections | 0.0468 |
Weighted residual factors for significantly intense reflections | 0.1141 |
Weighted residual factors for all reflections included in the refinement | 0.1214 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.054 |
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/4069900.html
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