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Information card for entry 2019961
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| Coordinates | 2019961.cif |
|---|---|
| Structure factors | 2019961.hkl |
| Original IUCr paper | HTML |
| Chemical name | 4-[(<i>E</i>)-(4-Nitrobenzylidene)amino]phenol |
|---|---|
| Formula | C13 H10 N2 O3 |
| Calculated formula | C13 H10 N2 O3 |
| Title of publication | Crystal structure of 4-[(E)-(4-nitrobenzylidene)amino]phenol |
| Authors of publication | Atioğlu, Zeliha; Akkurt, Mehmet; Jarrahpour, Aliasghar; Ebrahimi, Edris; Büyükgüngör, Orhan |
| Journal of publication | Acta Crystallographica Section E Crystallographic Communications |
| Year of publication | 2015 |
| Journal volume | 71 |
| Journal issue | 2 |
| Pages of publication | o113 |
| a | 12.3449 ± 0.0006 Å |
| b | 13.4266 ± 0.0006 Å |
| c | 15.7404 ± 0.0007 Å |
| α | 72.926 ± 0.004° |
| β | 67.39 ± 0.004° |
| γ | 76.824 ± 0.004° |
| Cell volume | 2282.6 ± 0.2 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1366 |
| Residual factor for significantly intense reflections | 0.0697 |
| Weighted residual factors for significantly intense reflections | 0.1665 |
| Weighted residual factors for all reflections included in the refinement | 0.1967 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.957 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| 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. |
2019961.cif 2019961.hkl |
| 136895 | 2015-05-18 | cif/ hkl/ Adding structures of 2019961 via cif-deposit CGI script. |
2019961.cif 2019961.hkl |
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Users of the data should acknowledge the original authors of the
structural data.