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Information card for entry 1558818
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| Coordinates | 1558818.cif |
|---|---|
| Structure factors | 1558818.hkl |
| Original IUCr paper | HTML |
| Chemical name | (<i>Z</i>)-<i>N</i>'-[(<i>E</i>)-4-Methoxybenzylidene]-2-(methoxyimino)-2-{2-[(2-methylphenoxy)methyl]phenyl}acetohydrazide |
|---|---|
| Formula | C25 H25 N3 O4 |
| Calculated formula | C25 H25 N3 O4 |
| SMILES | O(c1ccccc1C)Cc1ccccc1C(=N\OC)/C(=O)N/N=C/c1ccc(OC)cc1 |
| Title of publication | (<i>Z</i>)-<i>N</i>'-[(<i>E</i>)-4-Methoxybenzylidene]-2-(methoxyimino)-2-{2-[(2-methylphenoxy)methyl]phenyl}acetohydrazide |
| Authors of publication | Shripanavar, Chetan Shrimandhar; Butcher, Ray J. |
| Journal of publication | IUCrData |
| Year of publication | 2020 |
| Journal volume | 5 |
| Journal issue | 8 |
| Pages of publication | x201060 |
| a | 7.8041 ± 0.0006 Å |
| b | 22.8879 ± 0.0016 Å |
| c | 25.267 ± 0.0016 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 4513.2 ± 0.5 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 19 |
| Hermann-Mauguin space group symbol | P 21 21 21 |
| Hall space group symbol | P 2ac 2ab |
| Residual factor for all reflections | 0.1314 |
| Residual factor for significantly intense reflections | 0.0688 |
| Weighted residual factors for significantly intense reflections | 0.1184 |
| Weighted residual factors for all reflections included in the refinement | 0.1356 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.93 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 255207 (current) | 2020-08-08 | cif/ hkl/ Adding structures of 1558818 via cif-deposit CGI script. |
1558818.cif 1558818.hkl |
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Users of the data should acknowledge the original authors of the
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