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Information card for entry 2241827
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| Coordinates | 2241827.cif |
|---|---|
| Structure factors | 2241827.hkl |
| Original IUCr paper | HTML |
| Common name | (<i>E</i>)-4-Hydroxy-<i>N</i>'-(3-methoxybenzylidene)benzohydrazide |
|---|---|
| Chemical name | (<i>E</i>)-4-Hydroxy-<i>N</i>'-(3-methoxybenzylidene)benzohydrazide |
| Formula | C15 H14 N2 O3 |
| Calculated formula | C15 H14 N2 O3 |
| SMILES | O=C(N/N=C/c1cc(OC)ccc1)c1ccc(O)cc1 |
| Title of publication | Crystal structure of (<i>E</i>)-4-hydroxy-<i>N</i>'-(3-methoxybenzylidene)benzohydrazide |
| Authors of publication | Chantrapromma, Suchada; Prachumrat, Patcharawadee; Ruanwas, Pumsak; Boonnak, Nawong; Kassim, Mohammad B. |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2016 |
| Journal volume | 72 |
| Journal issue | 9 |
| Pages of publication | 1339 - 1342 |
| a | 9.2713 ± 0.0006 Å |
| b | 19.0235 ± 0.0011 Å |
| c | 15.6054 ± 0.0009 Å |
| α | 90° |
| β | 105.118 ± 0.002° |
| γ | 90° |
| Cell volume | 2657.1 ± 0.3 Å3 |
| Cell temperature | 300 ± 2 K |
| Ambient diffraction temperature | 300 ± 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 | 0.094 |
| Residual factor for significantly intense reflections | 0.0459 |
| Weighted residual factors for significantly intense reflections | 0.0874 |
| Weighted residual factors for all reflections included in the refinement | 0.1054 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.06 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 186044 (current) | 2016-08-27 | cif/ hkl/ Adding structures of 2241827 via cif-deposit CGI script. |
2241827.cif 2241827.hkl |
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Users of the data should acknowledge the original authors of the
structural data.