Information card for entry 2203639

Structure parameters

• Chemical name: 1-(2-piperidinoethyl)benzimidazole
• Formula: C14 H19 N3
• Calculated formula: C14 H19 N3
• SMILES: n1c2c(n(c1)CCN1CCCCC1)cccc2
• Title of publication: 1-(2-Piperidinoethyl)-1<i>H</i>-benzimidazole
• Authors of publication: Sevim Türktekin; Mehmet Akkurt; Nihat Şireci; Hasan Küçükbay; Orhan Büyükgüngör
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 5
• Pages of publication: o817 - o819
• a: 6.3741 ± 0.0008 Å
• b: 19.042 ± 0.002 Å
• c: 11.1476 ± 0.0014 Å
• α: 90°
• β: 102.178 ± 0.01°
• γ: 90°
• Cell volume: 1322.6 ± 0.3 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1098
• Residual factor for significantly intense reflections: 0.0405
• Weighted residual factors for significantly intense reflections: 0.0876
• Weighted residual factors for all reflections included in the refinement: 0.1045
• Goodness-of-fit parameter for all reflections included in the refinement: 0.803
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No