Information card for entry 2311217

Structure parameters

• Chemical name: (<i>E</i>)-<i>N</i>-(4-{[1-(Prop-2-en-1-yl)-1<i>H</i>-1,2,3-triazol-4-yl]methoxy}benzylidene)morpholin-4-amine
• Formula: C17 H21 N5 O2
• Calculated formula: C17 H21 N5 O2
• Title of publication: (E)-N-(4-{[1-(Prop-2-en-1-yl)-1H-1,2,3-triazol-4-yl]meth-oxy}benzyl-idene)morpholin-4-amine.
• Authors of publication: Akkurt, Mehmet; Jarrahpour, Aliasghar; Chermahini, Mehdi Mohammadi; Shiri, Pezhman; Ozdemir, Namık
• Journal of publication: Acta crystallographica. Section E, Structure reports online
• Year of publication: 2014
• Journal volume: 70
• Journal issue: Pt 3
• Pages of publication: o289 - 90
• a: 10.5992 ± 0.0008 Å
• b: 11.6351 ± 0.001 Å
• c: 14.8758 ± 0.0013 Å
• α: 95.811 ± 0.007°
• β: 100.724 ± 0.006°
• γ: 99.838 ± 0.006°
• Cell volume: 1759.1 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.1748
• Residual factor for significantly intense reflections: 0.0799
• Weighted residual factors for significantly intense reflections: 0.1796
• Weighted residual factors for all reflections included in the refinement: 0.2235
• Goodness-of-fit parameter for all reflections included in the refinement: 0.903
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No