Information card for entry 2221567

Structure parameters

• Chemical name: 1,3-Bis(2-ethoxyphenyl)triazene
• Formula: C16 H19 N3 O2
• Calculated formula: C16 H19 N3 O2
• SMILES: CCOc1ccccc1N/N=N/c1ccccc1OCC
• Title of publication: 1,3-Bis(2-ethoxyphenyl)triazene
• Authors of publication: Rofouei, Mohammad Kazem; Melardi, Mohammad Reza; Salemi, Yasaman; Kazemi, Saba Razi
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 4
• Pages of publication: o719
• a: 11.3971 ± 0.0007 Å
• b: 11.8696 ± 0.0007 Å
• c: 14.0627 ± 0.0009 Å
• α: 106.467 ± 0.005°
• β: 98.598 ± 0.005°
• γ: 116.512 ± 0.005°
• Cell volume: 1545.7 ± 0.2 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 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: 0.0898
• Residual factor for significantly intense reflections: 0.0576
• Weighted residual factors for significantly intense reflections: 0.1257
• Weighted residual factors for all reflections included in the refinement: 0.1384
• Goodness-of-fit parameter for all reflections included in the refinement: 1
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes