Information card for entry 2236773

Structure parameters

• Chemical name: 4-Morpholinecarboxamidine
• Formula: C5 H11 N3 O
• Calculated formula: C5 H11 N3 O
• SMILES: N=C(N)N1CCOCC1
• Title of publication: 4-Morpholinecarboxamidine
• Authors of publication: Tiritiris, Ioannis
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 11
• Pages of publication: o3118
• a: 16.591 ± 0.0006 Å
• b: 16.591 ± 0.0006 Å
• c: 9.7939 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2695.88 ± 0.16 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 88
• Hermann-Mauguin space group symbol: I 41/a :2
• Hall space group symbol: -I 4ad
• Residual factor for all reflections: 0.0497
• Residual factor for significantly intense reflections: 0.0371
• Weighted residual factors for significantly intense reflections: 0.0839
• Weighted residual factors for all reflections included in the refinement: 0.0905
• Goodness-of-fit parameter for all reflections included in the refinement: 1.062
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes