Information card for entry 2220265

Structure parameters

• Chemical name: Bis[1,3-bis(benzimidazol-2-yl)-2-oxapropane]copper(II)‒picrate‒\ dimethylformamide (1/2/4)
• Formula: C56 H60 Cu N18 O20
• Calculated formula: C56 H60 Cu N18 O20
• Title of publication: Bis[1,3-bis(benzimidazol-2-yl)-2-oxapropane]copper(II)‒picrate‒dimethylformamide (1/2/4)
• Authors of publication: Yun, Ruirui; Ying, Wei; Qi, Baoliang; Fan, Xuyang; Wu, Huilu
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 12
• Pages of publication: m1529
• a: 10.9656 ± 0.0007 Å
• b: 12.6028 ± 0.0012 Å
• c: 13.41 ± 0.0009 Å
• α: 65.746 ± 0.002°
• β: 88.629 ± 0.002°
• γ: 65.187 ± 0.002°
• Cell volume: 1508.8 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1161
• Residual factor for significantly intense reflections: 0.0747
• Weighted residual factors for significantly intense reflections: 0.2001
• Weighted residual factors for all reflections included in the refinement: 0.2324
• Goodness-of-fit parameter for all reflections included in the refinement: 1.015
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes