Information card for entry 7050429

Structure parameters

• Chemical name: 1,2-bis(1H-benzimidazolonium-2-yl)ethane tetrachlorocuprate(II) methanol solvate.
• Formula: C17 H20 Cl4 Cu N4 O
• Calculated formula: C17 H20 Cl4 Cu N4 O
• Title of publication: Molecular bricklaying: the protonated benzimidazole moiety as a synthon for crystal engineering
• Authors of publication: Matthews, Craig J.; Broughton, Vanessa; Bernardinelli, Gérald; Melich, Xavier; Brand, Guy; Willis, Anthony C.; Williams, Alan F.
• Journal of publication: New Journal of Chemistry
• Year of publication: 2003
• Journal volume: 27
• Journal issue: 2
• Pages of publication: 354
• a: 17.1984 ± 0.0013 Å
• b: 17.9232 ± 0.0009 Å
• c: 7.1133 ± 0.0005 Å
• α: 90°
• β: 101.599 ± 0.008°
• γ: 90°
• Cell volume: 2147.9 ± 0.3 ų
• Cell temperature: 200 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for significantly intense reflections: 0.035
• Weighted residual factors for all reflections included in the refinement: 0.036
• Goodness-of-fit parameter for all reflections included in the refinement: 1.791
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No