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Information card for entry 1566369
Preview
Coordinates | 1566369.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C19 H24 O3 |
---|---|
Calculated formula | C19 H24 O3 |
SMILES | OC[C@H](c1cc(c(cc1)CO)C)C[C@H](O)c1ccc(cc1)C |
Title of publication | Asymmetric β-arylation of cyclopropanols enabled by photoredox and nickel dual catalysis. |
Authors of publication | Wang, Jianhua; Li, Xiaoxun |
Journal of publication | Chemical science |
Year of publication | 2022 |
Journal volume | 13 |
Journal issue | 10 |
Pages of publication | 3020 - 3026 |
a | 9.16551 ± 0.00016 Å |
b | 10.4822 ± 0.0002 Å |
c | 17.5734 ± 0.0004 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 1688.36 ± 0.06 Å3 |
Cell temperature | 293 ± 0.02 K |
Ambient diffraction temperature | 293 ± 0.02 K |
Number of distinct elements | 3 |
Space group number | 19 |
Hermann-Mauguin space group symbol | P 21 21 21 |
Hall space group symbol | P 2ac 2ab |
Residual factor for all reflections | 0.0422 |
Residual factor for significantly intense reflections | 0.0396 |
Weighted residual factors for significantly intense reflections | 0.1004 |
Weighted residual factors for all reflections included in the refinement | 0.1025 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.098 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54184 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/1566369.html
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