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Information card for entry 7250427
Preview
| Coordinates | 7250427.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C19.92 H11.83 Cl1.83 F N5 O3 |
|---|---|
| Calculated formula | C19.917 H11.834 Cl1.834 F N5 O3 |
| Title of publication | Enantioselective synthesis of spiro[indoline-3,1′-pyrazolo[1,2-b]phthalazine] derivatives via an organocatalytic three-component cascade reaction |
| Authors of publication | Song, Luying; Sun, Yuhong; An, Renbo; Wang, Liming; Jin, Ying |
| Journal of publication | RSC Advances |
| Year of publication | 2025 |
| Journal volume | 15 |
| Journal issue | 21 |
| Pages of publication | 17031 - 17035 |
| a | 16.7979 ± 0.0006 Å |
| b | 22.4214 ± 0.0009 Å |
| c | 35.2924 ± 0.0011 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 13292.3 ± 0.8 Å3 |
| Cell temperature | 173 K |
| Ambient diffraction temperature | 173 K |
| Number of distinct elements | 6 |
| 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 | 0.0725 |
| Residual factor for significantly intense reflections | 0.0649 |
| Weighted residual factors for significantly intense reflections | 0.1716 |
| Weighted residual factors for all reflections included in the refinement | 0.1803 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.045 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 299780 (current) | 2025-05-22 | cif/ Adding structures of 7250427 via cif-deposit CGI script. |
7250427.cif |
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Users of the data should acknowledge the original authors of the
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