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Information card for entry 4518901
Preview
Coordinates | 4518901.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C24 H26 F N O4 S |
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Calculated formula | C24 H26 F N O4 S |
Title of publication | Cationic Co(I) Catalysts for Regiodivergent Hydroalkenylation of 1,6-Enynes: An Uncommon cis-β-C‒H Activation Leads to Z-Selective Coupling of Acrylates |
Authors of publication | Herbort, James H.; Lalisse, Remy F.; Hadad, Christopher M.; RajanBabu, T. V. |
Journal of publication | ACS Catalysis |
Year of publication | 2021 |
Pages of publication | 9605 - 9617 |
a | 9.641 ± 0.0004 Å |
b | 10.3467 ± 0.0005 Å |
c | 13.3148 ± 0.0005 Å |
α | 109.229 ± 0.001° |
β | 111.165 ± 0.001° |
γ | 92.216 ± 0.001° |
Cell volume | 1150.61 ± 0.09 Å3 |
Cell temperature | 100 K |
Ambient diffraction temperature | 100 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0387 |
Residual factor for significantly intense reflections | 0.0351 |
Weighted residual factors for significantly intense reflections | 0.0855 |
Weighted residual factors for all reflections included in the refinement | 0.0887 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.036 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Diffraction radiation X-ray symbol | K-L~3~ |
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/4518901.html
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Users of the data should acknowledge the original authors of the
structural data.