Information card for entry 2206712

Structure parameters

• Common name: 1,2-Bis(2-aminophenoxy)ethane
• Chemical name: 1,2-Bis(2-aminophenoxy)ethane
• Formula: C14 H16 N2 O2
• Calculated formula: C14 H16 N2 O2
• SMILES: Nc1ccccc1OCCOc1ccccc1N
• Title of publication: 1,2-Bis(2-aminophenoxy)ethane
• Authors of publication: Rademeyer, Melanie; Barkhuizen, David A.; Kruger, Hendrik G.; Maguire, Glenn E. M.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 9
• Pages of publication: o3014 - o3016
• a: 26.33 ± 0.02 Å
• b: 5.979 ± 0.008 Å
• c: 8.163 ± 0.01 Å
• α: 90°
• β: 105.14 ± 0.1°
• γ: 90°
• Cell volume: 1240 ± 3 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0675
• Residual factor for significantly intense reflections: 0.0608
• Weighted residual factors for significantly intense reflections: 0.1658
• Weighted residual factors for all reflections included in the refinement: 0.1769
• Goodness-of-fit parameter for all reflections included in the refinement: 1.088
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes