Information card for entry 8101901

Structure parameters

• Chemical name: (E)-4-methoxy-nitrophenone N-(2,4-dinitrophenyl)hydrazone
• Formula: C14 H11 N5 O7
• Calculated formula: C14 H11 N5 O7
• SMILES: N(=C(N(=O)=O)\c1ccc(OC)cc1)\Nc1ccc(N(=O)=O)cc1N(=O)=O
• Title of publication: Crystal structure of (E)-4-methoxy-nitrophenone N-(2,4-dinitrophenyl) hydrazone, C~14~H~11~N~5~O~7~
• Authors of publication: Zhao, L.-F.
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2006
• Journal volume: 221
• Journal issue: 1
• Pages of publication: 29 - 30
• a: 15.075 ± 0.002 Å
• b: 17.683 ± 0.003 Å
• c: 6.099 ± 0.001 Å
• α: 90°
• β: 100.43 ± 0.01°
• γ: 90°
• Cell volume: 1599 ± 0.4 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0983
• Residual factor for significantly intense reflections: 0.0545
• Weighted residual factors for significantly intense reflections: 0.1587
• Weighted residual factors for all reflections included in the refinement: 0.1745
• Goodness-of-fit parameter for all reflections included in the refinement: 0.993
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No