Information card for entry 2015163

Structure parameters

• Chemical name: Bis(1H-benzimidazol-2-ylmethyl)aminium chloride
• Formula: C16 H16 Cl N5
• Calculated formula: C16 H16 Cl N5
• Title of publication: 2,2'-(Iminodimethylene)bis(1<i>H</i>-benzimidazolium)(1+) chloride
• Authors of publication: Xue-Li Zhang; Sheng-Run Zheng; Yue-Peng Cai; Cheng-Yong Su
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 11
• Pages of publication: o642 - o644
• a: 7.607 ± 0.002 Å
• b: 13.615 ± 0.003 Å
• c: 14.544 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1506.3 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0332
• Residual factor for significantly intense reflections: 0.0266
• Weighted residual factors for significantly intense reflections: 0.0639
• Weighted residual factors for all reflections included in the refinement: 0.0672
• Goodness-of-fit parameter for all reflections included in the refinement: 1.009
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes