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Information card for entry 1549724
Preview
Coordinates | 1549724.cif |
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Original paper (by DOI) | HTML |
Formula | C15 H9 F7.05 |
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Calculated formula | C15 H9 F7.0485 |
Title of publication | <i>meta</i>-C-H arylation of fluoroarenes <i>via</i> traceless directing group relay strategy. |
Authors of publication | Font, Marc; Spencer, Andrew R. A.; Larrosa, Igor |
Journal of publication | Chemical science |
Year of publication | 2018 |
Journal volume | 9 |
Journal issue | 35 |
Pages of publication | 7133 - 7137 |
a | 12.069 ± 0.0005 Å |
b | 30.5791 ± 0.0011 Å |
c | 36.076 ± 0.002 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 13314.2 ± 1 Å3 |
Cell temperature | 150.02 ± 0.1 K |
Ambient diffraction temperature | 150.02 ± 0.1 K |
Number of distinct elements | 3 |
Space group number | 57 |
Hermann-Mauguin space group symbol | P b c m |
Hall space group symbol | -P 2c 2b |
Residual factor for all reflections | 0.2122 |
Residual factor for significantly intense reflections | 0.1041 |
Weighted residual factors for significantly intense reflections | 0.2713 |
Weighted residual factors for all reflections included in the refinement | 0.3542 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.035 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
228839 (current) | 2019-11-17 | cif/ Updating files of 1549724, 1549725 Original log message: Adding full bibliography for 1549724--1549725.cif. |
1549724.cif |
209246 | 2018-07-25 | cif/ Adding structures of 1549724, 1549725 via cif-deposit CGI script. |
1549724.cif |
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Users of the data should acknowledge the original authors of the
structural data.