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Information card for entry 1572242
Preview
Coordinates | 1572242.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C20 H11 Br O S2 |
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Calculated formula | C20 H11 Br O S2 |
Title of publication | Catalytic asymmetric functionalization and dearomatization of thiophenes. |
Authors of publication | Zhao, Zhengxing; Li, Yingxin; Jia, Shiqi; Peng, Lei; Zhang, Zian; Wu, Fengdi; Wang, Pengfei; Qin, Wenling; Lan, Yu; Yan, Hailong |
Journal of publication | Chemical science |
Year of publication | 2024 |
Journal volume | 15 |
Journal issue | 35 |
Pages of publication | 14295 - 14303 |
a | 7.4965 ± 0.0003 Å |
b | 19.112 ± 0.0007 Å |
c | 11.7078 ± 0.0004 Å |
α | 90° |
β | 96.131 ± 0.004° |
γ | 90° |
Cell volume | 1667.82 ± 0.11 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 5 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.0708 |
Residual factor for significantly intense reflections | 0.044 |
Weighted residual factors for significantly intense reflections | 0.0946 |
Weighted residual factors for all reflections included in the refinement | 0.1082 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.03 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
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/1572242.html
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