Information card for entry 2004253

Structure parameters

• Formula: C12 H7 N O3
• Calculated formula: C12 H7 N O3
• Title of publication: 3-Nitrodibenzofuran and 3-Iododibenzofuran
• Authors of publication: Chaloner, P. A.; Hitchcock, P. B.; Sutton, P. G.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1995
• Journal volume: 51
• Journal issue: 12
• Pages of publication: 2680 - 2683
• a: 6.886 ± 0.003 Å
• b: 7.106 ± 0.003 Å
• c: 10.591 ± 0.004 Å
• α: 75.23 ± 0.04°
• β: 84.72 ± 0.03°
• γ: 69.46 ± 0.03°
• Cell volume: 469.3 ± 0.4 ų
• Cell temperature: 293 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 significantly intense reflections: 0.047
• Weighted residual factors for significantly intense reflections: 0.056
• Goodness-of-fit parameter for significantly intense reflections: 1.8
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No