Information card for entry 2240708

Structure parameters

• Chemical name: {(<i>E</i>)-4-[(1-Allyl-1<i>H</i>-1,2,3-triazol-4-yl)methoxy]benzylidene}[2-(morpholin-4-yl)ethyl]amine
• Formula: C19 H25 N5 O2
• Calculated formula: C19 H25 N5 O2
• Title of publication: Crystal structure of {(<i>E</i>)-4-[(1-allyl-1<i>H</i>-1,2,3-triazol-4-yl)methoxy]benzylidene}[2-(morpholin-4-yl)ethyl]amine
• Authors of publication: Çelikesir, Sevim Türktekin; Akkurt, Mehmet; Jarrahpour, Aliasghar; Chermahini, Mehdi Mohammadi; Shiri, Pezhman; Büyükgüngör, Orhan
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2014
• Journal volume: 70
• Journal issue: 9
• Pages of publication: o933 - o934
• a: 22.3034 ± 0.001 Å
• b: 5.2531 ± 0.0003 Å
• c: 16.5878 ± 0.0008 Å
• α: 90°
• β: 93.051 ± 0.004°
• γ: 90°
• Cell volume: 1940.7 ± 0.17 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1234
• Residual factor for significantly intense reflections: 0.0543
• Weighted residual factors for significantly intense reflections: 0.1075
• Weighted residual factors for all reflections included in the refinement: 0.13
• Goodness-of-fit parameter for all reflections included in the refinement: 0.928
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes