Information card for entry 2233892

Structure parameters

• Chemical name: 1-(2-Methoxyphenyl)-2-{[2-(2-methoxyphenyl)hydrazinylidene](nitro)methyl}diazene
• Formula: C15 H15 N5 O4
• Calculated formula: C15 H15 N5 O4
• SMILES: C(=N\Nc1c(cccc1)OC)(\N=Nc1c(cccc1)OC)N(=O)=O
• Title of publication: 1-(2-Methoxyphenyl)-2-{[2-(2-methoxyphenyl)hydrazinylidene](nitro)methyl}diazene
• Authors of publication: von Eschwege, Karel G.; Muller, Fabian; Hill, Tania N.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 3
• Pages of publication: o609
• a: 7.2025 ± 0.0005 Å
• b: 10.9574 ± 0.0008 Å
• c: 11.219 ± 0.0009 Å
• α: 117.188 ± 0.002°
• β: 91.416 ± 0.002°
• γ: 107.251 ± 0.002°
• Cell volume: 738.66 ± 0.1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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 significantly intense reflections: 0.0374
• Weighted residual factors for all reflections included in the refinement: 0.11
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes