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Information card for entry 7064312
Preview
| Coordinates | 7064312.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C H N O |
|---|---|
| Calculated formula | C2.4186 H2.13953 N0.465116 O0.27907 |
| Title of publication | Solvent directed base-enabled diastereodivergent domino cycloaddition of isoxazole–oxindole styrenes and Michael additions of isoxazole–styrenes with vinyl malononitriles |
| Authors of publication | Sathish, Kota; Majhi, Subir; Parida, Ankita; Nagaraju, Sakkani; Kashinath, Dhurke |
| Journal of publication | New Journal of Chemistry |
| Year of publication | 2026 |
| Journal volume | 50 |
| Journal issue | 5 |
| Pages of publication | 2350 - 2355 |
| a | 9.341 ± 0.0002 Å |
| b | 12.3538 ± 0.0003 Å |
| c | 19.841 ± 0.0005 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2289.59 ± 0.09 Å3 |
| Cell temperature | 304.6 ± 0.2 K |
| Ambient diffraction temperature | 304.6 ± 0.2 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 | 0.0794 |
| Residual factor for significantly intense reflections | 0.0599 |
| Weighted residual factors for significantly intense reflections | 0.1617 |
| Weighted residual factors for all reflections included in the refinement | 0.1825 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.055 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
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Users of the data should acknowledge the original authors of the
structural data.