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Information card for entry 1556019
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Coordinates | 1556019.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | compound 3b |
---|---|
Chemical name | compound 3b |
Formula | C16 H11 F N2 O |
Calculated formula | C16 H11 F N2 O |
SMILES | [C@]1(c2ccccc2N(C1=O)C)(c1ccc(cc1)C#N)F |
Title of publication | Palladium-Catalyzed, Enantioselective α-Arylation of α-Fluorooxindoles. |
Authors of publication | Jin, Yushu; Chen, Ming; Ge, Shaozhong; Hartwig, John F. |
Journal of publication | Organic letters |
Year of publication | 2017 |
Journal volume | 19 |
Journal issue | 6 |
Pages of publication | 1390 - 1393 |
a | 8.4334 ± 0.0007 Å |
b | 9.1934 ± 0.0008 Å |
c | 16.9142 ± 0.0015 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 1311.4 ± 0.2 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 5 |
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 | 0.0444 |
Residual factor for significantly intense reflections | 0.041 |
Weighted residual factors for significantly intense reflections | 0.1012 |
Weighted residual factors for all reflections included in the refinement | 0.1045 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.133 |
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/1556019.html
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