Information card for entry 2013814

Structure parameters

• Common name: 4-{1-[(2,4-dinitrophenyl)-hydrazono]ethyl}benzene-1,3-diol N,N-dimethylformamide solvate
• Chemical name: 2,4-dihydroxyacetophenone 2,4-dinitrophenylhydrazone N,N-dimethylformamide solvate
• Formula: C17 H19 N5 O7
• Calculated formula: C17 H19 N5 O7
• SMILES: Oc1cc(O)c(cc1)/C(=N/Nc1ccc(N(=O)=O)cc1N(=O)=O)C.O=CN(C)C
• Title of publication: 2,4-Dinitrophenylhydrazones of 2,4-dihydroxybenzaldehyde, 2,4-dihydroxyacetophenone and 2,4-dihydroxybenzophenone
• Authors of publication: Baughman, Russell G.; Martin, Kenneth L.; Singh, Rajendra K.; Stoffer, James O.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 2
• Pages of publication: o103 - o106
• a: 7.928 ± 0.001 Å
• b: 9.146 ± 0.001 Å
• c: 14.362 ± 0.002 Å
• α: 104.45 ± 0.01°
• β: 91.04 ± 0.01°
• γ: 108.8 ± 0.01°
• Cell volume: 949.1 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 288 ± 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: 0.079
• Residual factor for significantly intense reflections: 0.047
• Weighted residual factors for significantly intense reflections: 0.123
• Weighted residual factors for all reflections included in the refinement: 0.142
• Goodness-of-fit parameter for all reflections included in the refinement: 1.014
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes