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Information card for entry 7063426
Preview
| Coordinates | 7063426.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C25 H19 Cl2 N3 O2 |
|---|---|
| Calculated formula | C25 H19 Cl2 N3 O2 |
| Title of publication | Convenient synthesis of spiro-pyrazolone–pyrrolidinones via ipso-cyclization of arylidene pyrazolones with 2-chloro-N-phenylacetamides |
| Authors of publication | Gond, Kavyashree Kuppayya; Maddani, Mahagundappa Rachappa |
| Journal of publication | New Journal of Chemistry |
| Year of publication | 2024 |
| Journal volume | 48 |
| Journal issue | 36 |
| Pages of publication | 15866 - 15869 |
| a | 13.1578 ± 0.0001 Å |
| b | 7.9741 ± 0.0001 Å |
| c | 20.9819 ± 0.0002 Å |
| α | 90° |
| β | 91.086 ± 0.001° |
| γ | 90° |
| Cell volume | 2201.06 ± 0.04 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/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0411 |
| Residual factor for significantly intense reflections | 0.0358 |
| Weighted residual factors for significantly intense reflections | 0.0926 |
| Weighted residual factors for all reflections included in the refinement | 0.0963 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.068 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 295305 (current) | 2024-10-06 | cif/ Updating files of 7063426 Original log message: Adding full bibliography for 7063426.cif. |
7063426.cif |
| 294286 | 2024-08-30 | cif/ Adding structures of 7063426 via cif-deposit CGI script. |
7063426.cif |
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Users of the data should acknowledge the original authors of the
structural data.