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Information card for entry 2238156
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| Coordinates | 2238156.cif |
|---|---|
| Structure factors | 2238156.hkl |
| Original IUCr paper | HTML |
| Chemical name | <i>N</i>'-[(<i>E</i>)-4-Benzyloxy-2-hydroxybenzylidene]-4-nitrobenzohydrazide dimethylformamide monosolvate |
|---|---|
| Formula | C24 H24 N4 O6 |
| Calculated formula | C24 H24 N4 O6 |
| SMILES | O(Cc1ccccc1)c1cc(O)c(cc1)/C=N/NC(=O)c1ccc(N(=O)=O)cc1.O=CN(C)C |
| Title of publication | <i>N</i>'-[(<i>E</i>)-4-Benzyloxy-2-hydroxybenzylidene]-4-nitrobenzohydrazide dimethylformamide monosolvate |
| Authors of publication | Joseph, Bibitha; Sithambaresan, M.; Kurup, M. R. Prathapachandra |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2013 |
| Journal volume | 69 |
| Journal issue | 7 |
| Pages of publication | o1160 - o1161 |
| a | 10.016 ± 0.0008 Å |
| b | 22.661 ± 0.002 Å |
| c | 10.2611 ± 0.0011 Å |
| α | 90° |
| β | 101.392 ± 0.005° |
| γ | 90° |
| Cell volume | 2283.1 ± 0.4 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 | 0.0987 |
| Residual factor for significantly intense reflections | 0.0528 |
| Weighted residual factors for significantly intense reflections | 0.1368 |
| Weighted residual factors for all reflections included in the refinement | 0.1759 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.038 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181303 (current) | 2016-04-03 | hkl/2/23/ (antanas@echidna) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/23/81. |
2238156.cif 2238156.hkl |
| 176798 | 2016-02-21 | cif/2/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/23. |
2238156.cif 2238156.hkl |
| 88055 | 2013-08-28 | cod/cif/ (saulius@koala.ibt.lt) Adding the _cod_database_fobs_code links for those COD CIFs that have their Fobs deposited recently. |
2238156.cif 2238156.hkl |
| 88054 | 2013-08-28 | cod/hkl/ (saulius@koala.ibt.lt) Adding Fobs files for the recently deposited IUCr coordinate data. |
2238156.cif 2238156.hkl |
| 87401 | 2013-08-27 | cif/ Adding structures of 2238156 via cif-deposit CGI script. |
2238156.cif |
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Users of the data should acknowledge the original authors of the
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