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Information card for entry 7157142
Preview
| Coordinates | 7157142.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C19 H18 F N3 O3 |
|---|---|
| Calculated formula | C19 H18 F N3 O3 |
| Title of publication | Highly regio- and diastereoselective [3 + 2]-cycloadditions involving indolediones and α,β-disubstituted nitroethylenes. |
| Authors of publication | Rao, Madhuri P.; Gunaga, Shubha S.; Zuegg, Johannes; Pamarthi, Rambabu; Ganesh, Madhu |
| Journal of publication | Organic & biomolecular chemistry |
| Year of publication | 2019 |
| Journal volume | 17 |
| Journal issue | 42 |
| Pages of publication | 9390 - 9402 |
| a | 19.0038 ± 0.0006 Å |
| b | 7.304 ± 0.0002 Å |
| c | 25.2096 ± 0.0007 Å |
| α | 90° |
| β | 108.964 ± 0.003° |
| γ | 90° |
| Cell volume | 3309.26 ± 0.18 Å3 |
| Cell temperature | 99.97 ± 0.1 K |
| Ambient diffraction temperature | 99.97 ± 0.1 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 | 0.0639 |
| Residual factor for significantly intense reflections | 0.0464 |
| Weighted residual factors for significantly intense reflections | 0.0959 |
| Weighted residual factors for all reflections included in the refinement | 0.1068 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.036 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 225105 (current) | 2019-11-08 | cif/ Updating files of 7157142, 7157143, 7157144 Original log message: Adding full bibliography for 7157142--7157144.cif. |
7157142.cif |
| 219173 | 2019-10-09 | cif/ Adding structures of 7157142, 7157143, 7157144 via cif-deposit CGI script. |
7157142.cif |
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Users of the data should acknowledge the original authors of the
structural data.