Information card for entry 7151676
Formula |
C20 H14 F3 N O3 |
Calculated formula |
C20 H14 F3 N O3 |
SMILES |
FC(F)(F)c1ccc(cc1)/C=C(/C(=O)C)CN1C(=O)c2ccccc2C1=O |
Title of publication |
Organocatalytic tandem three-component reaction of aldehyde, alkyl vinyl ketone, and amide: one-pot syntheses of highly functional alkenes. |
Authors of publication |
Wang, De-Wei; Syu, Siang-en; Hung, Yi-Ting; Chen, Pei-yi; Lee, Chia-Jui; Chen, Ko-Wei; Chen, Yu-Jhang; Lin, Wenwei |
Journal of publication |
Organic & biomolecular chemistry |
Year of publication |
2011 |
Journal volume |
9 |
Journal issue |
2 |
Pages of publication |
363 - 366 |
a |
8.779 ± 0.0002 Å |
b |
15.427 ± 0.0004 Å |
c |
12.67 ± 0.0004 Å |
α |
90° |
β |
94.858 ± 0.002° |
γ |
90° |
Cell volume |
1709.78 ± 0.08 Å3 |
Cell temperature |
293 ± 2 K |
Ambient diffraction temperature |
293 ± 2 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 |
0.0925 |
Residual factor for significantly intense reflections |
0.0589 |
Weighted residual factors for significantly intense reflections |
0.1862 |
Weighted residual factors for all reflections included in the refinement |
0.2306 |
Goodness-of-fit parameter for all reflections included in the refinement |
0.863 |
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/7151676.html