Information card for entry 2006466

Structure parameters

• Common name: α-(4‒Hydroxy phenyl)-N-Phenyl nitrone
• Chemical name: N-(p-Hydroxy Benzylidene)phenylamine N-oxide
• Formula: C13 H11 N O2
• Calculated formula: C13 H11 N O2
• SMILES: O=N(=Cc1ccc(O)cc1)c1ccccc1
• Title of publication: <i>N</i>-(<i>p</i>-Hydroxybenzylidene)phenylamine <i>N</i>-Oxide
• Authors of publication: Vijayalakshmi, L.; Parthasarathi, V.; Manishanker, P.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1997
• Journal volume: 53
• Journal issue: 9
• Pages of publication: 1343 - 1344
• a: 18.033 ± 0.009 Å
• b: 14.019 ± 0.009 Å
• c: 8.973 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2268 ± 2 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 4
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.146
• Residual factor for significantly intense reflections: 0.035
• Weighted residual factors for all reflections: 0.115
• Weighted residual factors for significantly intense reflections: 0.079
• Goodness-of-fit parameter for all reflections: 0.972
• Goodness-of-fit parameter for significantly intense reflections: 1.043
• Diffraction radiation wavelength: 0.7071 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No