Information card for entry 2206627

Structure parameters

• Chemical name: [2-(Benzimidazol-2-yl)phenolato]zinc(II)‒[2-(benzimidazol-2- yl)phenolato][2-(benzimidazol-2-yl)-4-bromophenolato]zinc(II)‒ethanol‒water (0.67/0.33/2/0.5)
• Formula: C30 H30.67 Br0.33 N5 O4.5 Zn
• Calculated formula: C30 H30.67 Br0.33 N4 O4.5 Zn
• Title of publication: Bis[2-(benzimidazol-2-yl)phenolato]zinc(II)‒[2-(benzimidazol-2-yl)phenolato][2-(benzimidazol-2-yl)-4-bromophenolato]zinc(II)‒ethanol‒water (0.67/0.33/2/0.5)
• Authors of publication: Tong, Yi-Ping
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 9
• Pages of publication: m1771 - m1773
• a: 32.459 ± 0.003 Å
• b: 9.408 ± 0.001 Å
• c: 19.053 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5818.3 ± 1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 45
• Hermann-Mauguin space group symbol: I b a 2
• Hall space group symbol: I 2 -2c
• Residual factor for all reflections: 0.1355
• Residual factor for significantly intense reflections: 0.0645
• Weighted residual factors for significantly intense reflections: 0.1657
• Weighted residual factors for all reflections included in the refinement: 0.2086
• Goodness-of-fit parameter for all reflections included in the refinement: 0.951
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No