Information card for entry 2221891

Structure parameters

• Common name: 2-Hydroxy-benzaldehyde-<i>O,O'</i>-(1,4-dioxobutane-1,4-diyl)-oxime
• Chemical name: Bis(2-hydroxybenzaldehyde oxime) <i>O</i>,<i>O</i>'-(butane-1,4-diyldicarbonyl) ether
• Formula: C20 H20 N2 O6
• Calculated formula: C20 H20 N2 O6
• SMILES: O=C(O/N=C/c1ccccc1O)CCCCC(=O)O/N=C/c1ccccc1O
• Title of publication: Bis(2-hydroxybenzaldehyde oxime) <i>O</i>,<i>O</i>'-butane-1,4-diyldicarbonyl ether
• Authors of publication: Etemadi, Bijan; Kia, Reza; Sharghi, Hashem; Hosseini Sarvari, Mona
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 6
• Pages of publication: o1309
• a: 13.0293 ± 0.0011 Å
• b: 5.5464 ± 0.0004 Å
• c: 25.538 ± 0.002 Å
• α: 90°
• β: 91.348 ± 0.007°
• γ: 90°
• Cell volume: 1845 ± 0.3 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0595
• Residual factor for significantly intense reflections: 0.0473
• Weighted residual factors for significantly intense reflections: 0.0968
• Weighted residual factors for all reflections included in the refinement: 0.0992
• Goodness-of-fit parameter for all reflections included in the refinement: 1.095
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes