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Information card for entry 1543261
Preview
Coordinates | 1543261.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C26 H21 F N2 O4 S |
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Calculated formula | C26 H21 F N2 O4 S |
SMILES | S(=O)(=O)(NC(=O)C(=C1\c2cc(F)ccc2N(C1=O)CC=C)\c1ccccc1)c1ccc(cc1)C |
Title of publication | Tuning of Copper-Catalyzed Multicomponent Reactions toward 3-Functionalized Oxindoles. |
Authors of publication | Cheng, Dong; Ling, Fei; Zheng, Chenguang; Ma, Cheng |
Journal of publication | Organic letters |
Year of publication | 2016 |
Journal volume | 18 |
Journal issue | 10 |
Pages of publication | 2435 - 2438 |
a | 9.8714 ± 0.0007 Å |
b | 11.0898 ± 0.0008 Å |
c | 12.4017 ± 0.0006 Å |
α | 75.477 ± 0.005° |
β | 84.873 ± 0.005° |
γ | 77.924 ± 0.006° |
Cell volume | 1284.2 ± 0.15 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0987 |
Residual factor for significantly intense reflections | 0.0512 |
Weighted residual factors for significantly intense reflections | 0.1293 |
Weighted residual factors for all reflections included in the refinement | 0.1388 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.868 |
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/1543261.html
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Users of the data should acknowledge the original authors of the
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