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Information card for entry 7130367
Preview
Coordinates | 7130367.cif |
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Original paper (by DOI) | HTML |
Formula | C11 H6 Cl F3 O3 |
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Calculated formula | C11 H6 Cl F3 O3 |
Title of publication | Cp*Ir(III) and Cp*Rh(III)-catalyzed annulation of salicylaldehydes with fluorinated vinyl tosylates. |
Authors of publication | Zhao, Shuwen; Cai, Xiaojia; Lu, Yuying; Hu, Jinhui; Xiong, Zhuang; Jin, Jingwei; Li, Yin; Wang, Honggen; Wu, Jia-Qiang |
Journal of publication | Chemical communications (Cambridge, England) |
Year of publication | 2022 |
a | 4.7255 ± 0.0001 Å |
b | 22.4433 ± 0.0007 Å |
c | 10.8444 ± 0.0003 Å |
α | 90° |
β | 94.625 ± 0.003° |
γ | 90° |
Cell volume | 1146.37 ± 0.05 Å3 |
Cell temperature | 297.56 ± 0.1 K |
Ambient diffraction temperature | 297.56 ± 0.1 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.074 |
Residual factor for significantly intense reflections | 0.0654 |
Weighted residual factors for significantly intense reflections | 0.1875 |
Weighted residual factors for all reflections included in the refinement | 0.1968 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.096 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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The link is: https://www.crystallography.net/7130367.html
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