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Information card for entry 1571787
Preview
Coordinates | 1571787.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C18 H12 F2 O2 |
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Calculated formula | C18 H12 F2 O2 |
Title of publication | Divergent functionalization of alkenes enabled by photoredox activation of CDFA and α-halo carboxylic acids. |
Authors of publication | Giri, Rahul; Zhilin, Egor; Katayev, Dmitry |
Journal of publication | Chemical science |
Year of publication | 2024 |
Journal volume | 15 |
Journal issue | 27 |
Pages of publication | 10659 - 10667 |
a | 10.05628 ± 0.00017 Å |
b | 5.8382 ± 0.00012 Å |
c | 23.8712 ± 0.0004 Å |
α | 90° |
β | 100.565 ± 0.0017° |
γ | 90° |
Cell volume | 1377.73 ± 0.04 Å3 |
Cell temperature | 173.01 ± 0.1 K |
Ambient diffraction temperature | 173.01 ± 0.1 K |
Number of distinct elements | 4 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.0412 |
Residual factor for significantly intense reflections | 0.0386 |
Weighted residual factors for significantly intense reflections | 0.1097 |
Weighted residual factors for all reflections included in the refinement | 0.1114 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.065 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
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/1571787.html
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Users of the data should acknowledge the original authors of the
structural data.