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Information card for entry 7157597
Preview
Coordinates | 7157597.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C17 H13 N O2 S |
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Calculated formula | C17 H13 N O2 S |
Title of publication | Regioselective synthesis of substituted thiazoles via cascade reactions from 3-chlorochromones and thioamides. |
Authors of publication | Dai, Tianzi; Cui, Chen; Qi, Xueyu; Cheng, Yanshu; He, Qian; Zhang, Xiaofei; Luo, Xiaomin; Yang, Chunhao |
Journal of publication | Organic & biomolecular chemistry |
Year of publication | 2020 |
Journal volume | 18 |
Journal issue | 31 |
Pages of publication | 6162 - 6170 |
a | 7.6988 ± 0.0002 Å |
b | 11.4847 ± 0.0003 Å |
c | 30.9861 ± 0.0009 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 2739.74 ± 0.13 Å3 |
Cell temperature | 100 K |
Ambient diffraction temperature | 100.15 K |
Number of distinct elements | 5 |
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 | 0.0635 |
Residual factor for significantly intense reflections | 0.0447 |
Weighted residual factors for significantly intense reflections | 0.0974 |
Weighted residual factors for all reflections included in the refinement | 0.1082 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.021 |
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/7157597.html
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