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Information card for entry 8105327
Preview
| Coordinates | 8105327.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | 2-acetylpyridine m-anisoyl hydrazone |
|---|---|
| Chemical name | (<i>E</i>)-3-methoxy-<i>N</i>'-(1-(pyridin-2-yl)ethylidene)benzohydrazide |
| Formula | C15 H15 N3 O2 |
| Calculated formula | C15 H15 N3 O2 |
| SMILES | O=C(N/N=C(/c1ncccc1)C)c1cc(OC)ccc1 |
| Title of publication | Crystal structure of (E)-3-methoxy-N′-(1-(pyridin-2-yl)ethylidene)benzohydrazide, C15H15N3O2 |
| Authors of publication | Mossine, Valeri V.; Kelley, Steven P.; Mawhinney, Thomas P. |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2020 |
| Journal volume | 235 |
| Journal issue | 4 |
| Pages of publication | 907 - 909 |
| a | 7.9831 ± 0.0002 Å |
| b | 10.6486 ± 0.0003 Å |
| c | 15.7222 ± 0.0004 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1336.53 ± 0.06 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100.15 K |
| Number of distinct elements | 4 |
| Space group number | 29 |
| Hermann-Mauguin space group symbol | P c a 21 |
| Hall space group symbol | P 2c -2ac |
| Residual factor for all reflections | 0.0427 |
| Residual factor for significantly intense reflections | 0.034 |
| Weighted residual factors for significantly intense reflections | 0.0766 |
| Weighted residual factors for all reflections included in the refinement | 0.0799 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.046 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
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