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Information card for entry 2240715
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| Coordinates | 2240715.cif |
|---|---|
| Structure factors | 2240715.hkl |
| Original IUCr paper | HTML |
| Chemical name | <i>N</i>'-[(<i>E</i>)-Benzylidene]-2-(6-methoxynaphthalen-2-yl)propanohydrazide |
|---|---|
| Formula | C21 H20 N2 O2 |
| Calculated formula | C21 H20 N2 O2 |
| SMILES | O(C)c1cc2ccc(cc2cc1)[C@H](C)C(=O)N/N=C/c1ccccc1 |
| Title of publication | <i>N</i>'-[(<i>E</i>)-Benzylidene]-2-(6-methoxynaphthalen-2-yl)propanohydrazide |
| Authors of publication | Mague, Joel T.; Akkurt, Mehmet; Mohamed, Shaaban K.; El-Remaily, Mahmoud A. A.; Albayati, Mustafa R. |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2013 |
| Journal volume | 69 |
| Journal issue | 11 |
| Pages of publication | o1614 |
| a | 10.3754 ± 0.0017 Å |
| b | 32.519 ± 0.005 Å |
| c | 5.0615 ± 0.0008 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1707.7 ± 0.5 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 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 | 0.0567 |
| Residual factor for significantly intense reflections | 0.0516 |
| Weighted residual factors for significantly intense reflections | 0.1255 |
| Weighted residual factors for all reflections included in the refinement | 0.1284 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.099 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181907 (current) | 2016-04-06 | hkl/2/24/ (antanas@echidna) Adding IUCr specific svn headers to multiple entries in subrange 2/24/07 |
2240715.cif 2240715.hkl |
| 136874 | 2015-05-18 | cif/ hkl/ Adding structures of 2240715 via cif-deposit CGI script. |
2240715.cif 2240715.hkl |
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Users of the data should acknowledge the original authors of the
structural data.