Information card for entry 2220883

Structure parameters

• Chemical name: 2-Methoxybenzaldehyde 2,4-dinitrophenylhydrazone
• Formula: C14 H12 N4 O5
• Calculated formula: C14 H12 N4 O5
• SMILES: O(c1ccccc1/C=N/Nc1ccc(N(=O)=O)cc1N(=O)=O)C
• Title of publication: 2-Methoxybenzaldehyde 2,4-dinitrophenylhydrazone
• Authors of publication: Fun, Hoong-Kun; Kia, Reza; Kargar, Hadi
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 2
• Pages of publication: o246 - o247
• a: 7.0315 ± 0.0001 Å
• b: 7.6205 ± 0.0002 Å
• c: 14.1896 ± 0.0004 Å
• α: 98.048 ± 0.001°
• β: 97.064 ± 0.001°
• γ: 109.467 ± 0.001°
• Cell volume: 697.99 ± 0.03 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 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: 0.0512
• Residual factor for significantly intense reflections: 0.0446
• Weighted residual factors for significantly intense reflections: 0.1212
• Weighted residual factors for all reflections included in the refinement: 0.126
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes