Information card for entry 2204184

Structure parameters

• Chemical name: 2-(2-Ethoxyphenyl)-1-ethyl-1H-benzimidazole
• Formula: C17 H18 N2 O
• Calculated formula: C17 H18 N2 O
• SMILES: n1(c(nc2ccccc12)c1c(OCC)cccc1)CC
• Title of publication: 2-(2-Ethoxyphenyl)-1-ethyl-1<i>H</i>-benzimidazole
• Authors of publication: Tong, Yi-Ping; Li, Wei
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 9
• Pages of publication: o1563 - o1565
• a: 9.3305 ± 0.0008 Å
• b: 12.407 ± 0.001 Å
• c: 12.7422 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1475.1 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0653
• Residual factor for significantly intense reflections: 0.0499
• Weighted residual factors for significantly intense reflections: 0.1031
• Weighted residual factors for all reflections included in the refinement: 0.1097
• Goodness-of-fit parameter for all reflections included in the refinement: 1.077
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes