Iridium-Catalyzed Enantioselective and Diastereoselective Hydrogenation of 1,3-Disubstituted Isoquinolines
Authors of publication
Kim, Alexia N.; Ngamnithiporn, Aurapat; Welin, Eric R.; Daiger, Martin T.; Grünanger, Christian U.; Bartberger, Michael D.; Virgil, Scott C.; Stoltz, Brian M.
Journal of publication
ACS Catalysis
Year of publication
2020
Pages of publication
3241 - 3248
a
8.3309 ± 0.0019 Å
b
6.6556 ± 0.0018 Å
c
10.916 ± 0.003 Å
α
90°
β
96.337 ± 0.008°
γ
90°
Cell volume
601.6 ± 0.3 Å3
Cell temperature
100 K
Ambient diffraction temperature
100 K
Number of distinct elements
5
Space group number
4
Hermann-Mauguin space group symbol
P 1 21 1
Hall space group symbol
P 2yb
Residual factor for all reflections
0.0484
Residual factor for significantly intense reflections
0.0383
Weighted residual factors for significantly intense reflections
0.0909
Weighted residual factors for all reflections included in the refinement
0.096
Goodness-of-fit parameter for all reflections included in the refinement