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Information card for entry 7160345
Preview
| Coordinates | 7160345.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C24 H19 Cl N2 O6 |
|---|---|
| Calculated formula | C24 H19 Cl N2 O6 |
| Title of publication | Microwave-Assisted [3+2] Cycloaddition Reactions of Dicyanoepoxides with Benzylidene Meldrum’s Acids |
| Authors of publication | Lotfi Nosood, Yazdanbakhsh; Fattahi Ghahnavieh, Negin; Takallou, Ahmad; Rostami, Ali; Ebrahimi, Amirhossein; Anwar, Muhammad Usman; Al-Harrasi, Ahmed |
| Journal of publication | Organic & Biomolecular Chemistry |
| Year of publication | 2025 |
| a | 8.8296 ± 0.0004 Å |
| b | 23.8348 ± 0.0013 Å |
| c | 12.1335 ± 0.0007 Å |
| α | 90° |
| β | 109.541 ± 0.002° |
| γ | 90° |
| Cell volume | 2406.4 ± 0.2 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 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 | 0.1126 |
| Residual factor for significantly intense reflections | 0.0676 |
| Weighted residual factors for significantly intense reflections | 0.1461 |
| Weighted residual factors for all reflections included in the refinement | 0.1804 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.065 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 297467 (current) | 2025-01-25 | cif/ Adding structures of 7160345, 7160346 via cif-deposit CGI script. |
7160345.cif |
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Users of the data should acknowledge the original authors of the
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