Information card for entry 7130083
Formula |
C25 H22 Cl O5 |
Calculated formula |
C25 H22 Cl O5 |
Title of publication |
Copper-catalyzed asymmetric 1,6-conjugate addition of in situ generated para-quinone methides with β-ketoesters |
Authors of publication |
Wang, Yifeng; Wang, Chao-Jie; Feng, Qing-Zhou; Zhai, Jing-Jing; Qi, Suosuo; Zhong, Ai-Guo; Chu, Mingming; Xu, Dan-Qian |
Journal of publication |
Chemical Communications |
Year of publication |
2022 |
a |
9.142 ± 0.0011 Å |
b |
11.428 ± 0.0015 Å |
c |
22.267 ± 0.0019 Å |
α |
90° |
β |
90° |
γ |
90° |
Cell volume |
2326.3 ± 0.5 Å3 |
Cell temperature |
173 K |
Ambient diffraction temperature |
173 K |
Number of distinct elements |
4 |
Space group number |
19 |
Hermann-Mauguin space group symbol |
P 21 21 21 |
Hall space group symbol |
P 2ac 2ab |
Residual factor for all reflections |
0.0985 |
Residual factor for significantly intense reflections |
0.069 |
Weighted residual factors for significantly intense reflections |
0.1784 |
Weighted residual factors for all reflections included in the refinement |
0.2075 |
Goodness-of-fit parameter for all reflections included in the refinement |
0.981 |
Diffraction radiation probe |
x-ray |
Diffraction radiation wavelength |
1.54178 Å |
Diffraction radiation type |
CuKα |
Has coordinates |
Yes |
Has disorder |
No |
Has Fobs |
No |
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https://www.crystallography.net/7130083.html