Coligand Role in the NHC Nickel catalyzed C‒F Bond Activation: Investigations on the Insertion of bis(NHC) Nickel into the C‒F Bond of Hexafluorobenzene
Authors of publication
Kuntze-Fechner, Maximilian; Holthausen, Max C C.; Marder, Todd B.; Braunschweig, Holger; Krummenacher, Ivo; Radius, Udo; Tendera, Lukas; Verplancke, Hendrik; Diefenbach, Martin
Journal of publication
Chemical Science
Year of publication
2020
a
20.5349 ± 0.001 Å
b
18.6375 ± 0.0009 Å
c
22.7188 ± 0.0012 Å
α
90°
β
90°
γ
90°
Cell volume
8694.9 ± 0.8 Å3
Cell temperature
200 ± 2 K
Ambient diffraction temperature
200 ± 2 K
Number of distinct elements
5
Space group number
61
Hermann-Mauguin space group symbol
P b c a
Hall space group symbol
-P 2ac 2ab
Residual factor for all reflections
0.0815
Residual factor for significantly intense reflections
0.0567
Weighted residual factors for significantly intense reflections
0.1233
Weighted residual factors for all reflections included in the refinement
0.1358
Goodness-of-fit parameter for all reflections included in the refinement
