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Information card for entry 7128600
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Coordinates | 7128600.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C11 H11 Cl F N O |
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Calculated formula | C11 H11 Cl F N O |
Title of publication | Accessing novel fluorinated heterocycles with the hypervalent fluoroiodane reagent by solution and mechanochemical synthesis. |
Authors of publication | Riley, William; Jones, Andrew C.; Singh, Kuldip; Browne, Duncan L.; Stuart, Alison M. |
Journal of publication | Chemical communications (Cambridge, England) |
Year of publication | 2021 |
Journal volume | 57 |
Journal issue | 60 |
Pages of publication | 7406 - 7409 |
a | 9.503 ± 0.006 Å |
b | 9.161 ± 0.006 Å |
c | 24.001 ± 0.015 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 2089 ± 2 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 6 |
Space group number | 61 |
Hermann-Mauguin space group symbol | P b c a |
Hall space group symbol | -P 2ac 2ab |
Residual factor for all reflections | 0.1401 |
Residual factor for significantly intense reflections | 0.0865 |
Weighted residual factors for significantly intense reflections | 0.1974 |
Weighted residual factors for all reflections included in the refinement | 0.2267 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.037 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/7128600.html
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Users of the data should acknowledge the original authors of the
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