Information card for entry 2221078

Structure parameters

• Chemical name: <i>N</i>-[Morpholino(phenyl)methyl]benzamide
• Formula: C18 H20 N2 O2
• Calculated formula: C18.003 H20.003 N2 O2
• SMILES: O=C(c1ccccc1)NC(c1ccccc1)N1CCOCC1
• Title of publication: <i>N</i>-[Morpholino(phenyl)methyl]benzamide
• Authors of publication: Muruganandam, L.; Rajeswari, S.; Tamilvendan, D.; Ramkumar, V.; Prabhu, G. Venkatesa
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 3
• Pages of publication: o578
• a: 9.919 ± 0.0003 Å
• b: 10.6793 ± 0.0003 Å
• c: 15.805 ± 0.0005 Å
• α: 79.747 ± 0.002°
• β: 85.543 ± 0.001°
• γ: 85.467 ± 0.001°
• Cell volume: 1638.84 ± 0.09 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 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: 0.1087
• Residual factor for significantly intense reflections: 0.0523
• Weighted residual factors for significantly intense reflections: 0.1286
• Weighted residual factors for all reflections included in the refinement: 0.1563
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes