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Information card for entry 2241827
Preview
Coordinates | 2241827.cif |
---|---|
Structure factors | 2241827.hkl |
Original IUCr paper | HTML |
Common name | (<i>E</i>)-4-Hydroxy-<i>N</i>'-(3-methoxybenzylidene)benzohydrazide |
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Chemical name | (<i>E</i>)-4-Hydroxy-<i>N</i>'-(3-methoxybenzylidene)benzohydrazide |
Formula | C15 H14 N2 O3 |
Calculated formula | C15 H14 N2 O3 |
SMILES | O=C(N/N=C/c1cc(OC)ccc1)c1ccc(O)cc1 |
Title of publication | Crystal structure of (<i>E</i>)-4-hydroxy-<i>N</i>'-(3-methoxybenzylidene)benzohydrazide |
Authors of publication | Chantrapromma, Suchada; Prachumrat, Patcharawadee; Ruanwas, Pumsak; Boonnak, Nawong; Kassim, Mohammad B. |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2016 |
Journal volume | 72 |
Journal issue | 9 |
Pages of publication | 1339 - 1342 |
a | 9.2713 ± 0.0006 Å |
b | 19.0235 ± 0.0011 Å |
c | 15.6054 ± 0.0009 Å |
α | 90° |
β | 105.118 ± 0.002° |
γ | 90° |
Cell volume | 2657.1 ± 0.3 Å3 |
Cell temperature | 300 ± 2 K |
Ambient diffraction temperature | 300 ± 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 | 0.094 |
Residual factor for significantly intense reflections | 0.0459 |
Weighted residual factors for significantly intense reflections | 0.0874 |
Weighted residual factors for all reflections included in the refinement | 0.1054 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.06 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
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