Information card for entry 2239213

Structure parameters

• Chemical name: (<i>E</i>)-2-{[(Furan-2-ylmethyl)imino]methyl}-4-nitrophenol
• Formula: C12 H10 N2 O4
• Calculated formula: C12 H10 N2 O4
• Title of publication: (<i>E</i>)-2-{[(Furan-2-ylmethyl)imino]methyl}-4-nitrophenol
• Authors of publication: Hijji, Yousef; Azemati, Samira; Butcher, Ray J.; Jasinski, Jerry P.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2014
• Journal volume: 70
• Journal issue: 4
• Pages of publication: o451 - o452
• a: 5.4427 ± 0.0007 Å
• b: 8.2488 ± 0.001 Å
• c: 12.4701 ± 0.0014 Å
• α: 98.901 ± 0.009°
• β: 92.04 ± 0.01°
• γ: 91.69 ± 0.01°
• Cell volume: 552.41 ± 0.12 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 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: 0.0439
• Residual factor for significantly intense reflections: 0.0416
• Weighted residual factors for significantly intense reflections: 0.1184
• Weighted residual factors for all reflections included in the refinement: 0.122
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes