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Information card for entry 4083786
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Coordinates | 4083786.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | NX013 |
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Formula | C33 H27 F6 N2 O4 P Pd |
Calculated formula | C33 H27 F6 N2 O4 P Pd |
Title of publication | Palladium(II) Complexes Bearing an Indazole-Derived N-Heterocyclic Carbene and Phosphine Coligands as Catalysts for the Sonogashira Coupling and the Hydroamination of Alkynes |
Authors of publication | Bernhammer, Jan C.; Chong, Ning Xi; Jothibasu, Ramasamy; Zhou, Binbin; Huynh, Han Vinh |
Journal of publication | Organometallics |
Year of publication | 2014 |
Pages of publication | 140627160434001 |
a | 10.868 ± 0.01 Å |
b | 16.543 ± 0.015 Å |
c | 17.842 ± 0.016 Å |
α | 90° |
β | 96.674 ± 0.014° |
γ | 90° |
Cell volume | 3186 ± 5 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 7 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.0635 |
Residual factor for significantly intense reflections | 0.0518 |
Weighted residual factors for significantly intense reflections | 0.1272 |
Weighted residual factors for all reflections included in the refinement | 0.1338 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.052 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4083786.html
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structural data.