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Information card for entry 4134166
Preview
Coordinates | 4134166.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C23 H32 B2 N2 O2 |
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Calculated formula | C23 H32 B2 N2 O2 |
SMILES | [C@H](CC1CCCC1)(B1Nc2cccc3cccc(c23)N1)B1OC(C(C)(C)O1)(C)C |
Title of publication | A Boron Activating Effect Enables Cobalt-Catalyzed Asymmetric Hydrogenation of Sterically Hindered Alkenes. |
Authors of publication | Viereck, Peter; Krautwald, Simon; Pabst, Tyler P.; Chirik, Paul J. |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2020 |
Journal volume | 142 |
Journal issue | 8 |
Pages of publication | 3923 - 3930 |
a | 9.9436 ± 0.0003 Å |
b | 10.0616 ± 0.0003 Å |
c | 33.1823 ± 0.001 Å |
α | 90° |
β | 94.971 ± 0.001° |
γ | 90° |
Cell volume | 3307.35 ± 0.17 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 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 | 0.0483 |
Residual factor for significantly intense reflections | 0.0461 |
Weighted residual factors for significantly intense reflections | 0.1253 |
Weighted residual factors for all reflections included in the refinement | 0.1281 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.123 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
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/4134166.html
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