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Information card for entry 2243982
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| Coordinates | 2243982.cif |
|---|---|
| Structure factors | 2243982.hkl |
| Original IUCr paper | HTML |
| Chemical name | 3-[2-(3,5-Dimethylphenyl)hydrazinylidene]benzofuran-2(3<i>H</i>)-one |
|---|---|
| Formula | C16 H14 N2 O2 |
| Calculated formula | C16 H14 N2 O2 |
| Title of publication | Crystal structure and Hirshfeld surface analysis of 3-[2-(3,5-dimethylphenyl)hydrazinylidene]benzofuran-2(3<i>H</i>)-one |
| Authors of publication | Atioğlu, Zeliha; Akkurt, Mehmet; Shikhaliyev, Namiq Q.; Askerova, Ulviyya F.; Mukhtarova, Sevinc H.; Askerov, Rizvan K.; Bhattarai, Ajaya |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2021 |
| Journal volume | 77 |
| Journal issue | 12 |
| Pages of publication | 1280 - 1284 |
| a | 8.8644 ± 0.0004 Å |
| b | 19.9222 ± 0.0008 Å |
| c | 8.1736 ± 0.0003 Å |
| α | 90° |
| β | 107.24 ± 0.001° |
| γ | 90° |
| Cell volume | 1378.59 ± 0.1 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 4 |
| 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 | 0.1214 |
| Residual factor for significantly intense reflections | 0.0624 |
| Weighted residual factors for significantly intense reflections | 0.1208 |
| Weighted residual factors for all reflections included in the refinement | 0.1461 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.035 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 271902 (current) | 2022-01-07 | cif/ hkl/ Adding structures of 2243982 via cif-deposit CGI script. |
2243982.cif 2243982.hkl |
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Users of the data should acknowledge the original authors of the
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