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Information card for entry 2019951
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| Coordinates | 2019951.cif |
|---|---|
| Structure factors | 2019951.hkl |
| Original IUCr paper | HTML |
| Common name | (<i>E</i>)-2-Hydroxy-4'-methoxyazastilbene |
|---|---|
| Chemical name | (<i>E</i>)-2-[(4-Methoxybenzylidene)amino]phenol |
| Formula | C14 H13 N O2 |
| Calculated formula | C14 H13 N O2 |
| SMILES | O(c1ccc(cc1)/C=N/c1c(O)cccc1)C |
| Title of publication | Crystal structure of (E)-2-hydroxy-4′-methoxyazastilbene |
| Authors of publication | Chantrapromma, Suchada; Kaewmanee, Narissara; Boonnak, Nawong; Chantrapromma, Kan; Ghabbour, Hazem A.; Fun, Hoong-Kun |
| Journal of publication | Acta Crystallographica Section E Crystallographic Communications |
| Year of publication | 2015 |
| Journal volume | 71 |
| Journal issue | 6 |
| Pages of publication | 571 |
| a | 8.0357 ± 0.0003 Å |
| b | 5.5554 ± 0.0002 Å |
| c | 12.8733 ± 0.0005 Å |
| α | 90° |
| β | 101.312 ± 0.001° |
| γ | 90° |
| Cell volume | 563.52 ± 0.04 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100 ± 0.1 K |
| Number of distinct elements | 4 |
| Space group number | 7 |
| Hermann-Mauguin space group symbol | P 1 c 1 |
| Hall space group symbol | P -2yc |
| Residual factor for all reflections | 0.0369 |
| Residual factor for significantly intense reflections | 0.0366 |
| Weighted residual factors for significantly intense reflections | 0.0993 |
| Weighted residual factors for all reflections included in the refinement | 0.0996 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.09 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181869 (current) | 2016-04-06 | hkl/2/01/ (antanas@echidna) Adding IUCr specific svn headers to multiple entries in subrange 2/01/99. |
2019951.cif 2019951.hkl |
| 136425 | 2015-05-13 | cif/ hkl/ Adding structures of 2019951 via cif-deposit CGI script. |
2019951.cif 2019951.hkl |
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Users of the data should acknowledge the original authors of the
structural data.