Information card for entry 2216381

Structure parameters

• Chemical name: N,N'-Dibenzyl-2,2'-ethylenedioxydibenzamide
• Formula: C30 H28 N2 O4
• Calculated formula: C30 H28 N2 O4
• SMILES: O=C(c1ccccc1OCCOc1ccccc1C(=O)NCc1ccccc1)NCc1ccccc1
• Title of publication: <i>N</i>,<i>N</i>'-Dibenzyl-2,2'-ethylenedioxydibenzamide
• Authors of publication: Hui-Ling Wen; Qing-Hua Huang; Yong-Hong Wen
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 12
• Pages of publication: o4547 - o4547
• a: 5.062 ± 0.0013 Å
• b: 16.401 ± 0.004 Å
• c: 15.056 ± 0.004 Å
• α: 90°
• β: 96.522 ± 0.005°
• γ: 90°
• Cell volume: 1241.9 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.1163
• Residual factor for significantly intense reflections: 0.0693
• Weighted residual factors for significantly intense reflections: 0.1781
• Weighted residual factors for all reflections included in the refinement: 0.2072
• Goodness-of-fit parameter for all reflections included in the refinement: 1.116
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes