Information card for entry 2207093

Structure parameters

• Chemical name: N,N'-Bis(3-nitrobenzylidene)hydrazine
• Formula: C14 H10 N4 O4
• Calculated formula: C14 H10 N4 O4
• SMILES: c1(N(=O)=O)cccc(C=NN=Cc2cccc(c2)N(=O)=O)c1
• Title of publication: <i>N</i>,<i>N</i>'-Bis(3-nitrobenzylidene)hydrazine
• Authors of publication: Zheng, Peng-Wu; Wang, Wei; Duan, Xue-Min
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 10
• Pages of publication: o3485 - o3486
• a: 6.9694 ± 0.0019 Å
• b: 7.833 ± 0.002 Å
• c: 12.99 ± 0.004 Å
• α: 90°
• β: 105.175 ± 0.004°
• γ: 90°
• Cell volume: 684.4 ± 0.3 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0641
• Residual factor for significantly intense reflections: 0.0381
• Weighted residual factors for significantly intense reflections: 0.0949
• Weighted residual factors for all reflections included in the refinement: 0.1158
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes