Information card for entry 2009801

Structure parameters

• Chemical name: Structure of 5-nitro-2-furaldehyde-semicarbazone
• Formula: C6 H6 N4 O4
• Calculated formula: C6 H6 N4 O4
• Title of publication: 5-Nitro-2-furaldehyde semicarbazone
• Authors of publication: Olszak, Tomasz A.; Peeters, Oswald M.; Blaton, Norbert M.; De Ranter, Camiel J.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1994
• Journal volume: 50
• Journal issue: 6
• Pages of publication: 948 - 950
• a: 9.943 ± 0.001 Å
• b: 8.402 ± 0.001 Å
• c: 10.22 ± 0.001 Å
• α: 90°
• β: 101.18 ± 0.01°
• γ: 90°
• Cell volume: 837.59 ± 0.16 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/a 1
• Hall space group symbol: -P 2yab
• Residual factor for significantly intense reflections: 0.0428
• Weighted residual factors for significantly intense reflections: 0.0765
• Goodness-of-fit parameter for significantly intense reflections: 0.939
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No