Information card for entry 4501437

Structure parameters

• Formula: C25 H26 I2 N4 O Zn
• Calculated formula: C25 H25 I2 N4 O Zn
• SMILES: I[Zn](I)([n]1c(n(c2c1cccc2)C)Cc1ccc(cc1)Cc1n(c2c(n1)cccc2)C)[OH]C
• Title of publication: Coordination Polymers of Flexible Bis(benzimidazole) Ligand: Halogen Bridging and Metal···Arene Interactions
• Authors of publication: Samai, Suman; Biradha, Kumar
• Journal of publication: Crystal Growth & Design
• Year of publication: 2011
• Journal volume: 11
• Journal issue: 12
• Pages of publication: 5723
• a: 10.847 ± 0.003 Å
• b: 10.99 ± 0.004 Å
• c: 11.076 ± 0.004 Å
• α: 83.459 ± 0.012°
• β: 85.689 ± 0.01°
• γ: 84.363 ± 0.011°
• Cell volume: 1302.7 ± 0.8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.2261
• Residual factor for significantly intense reflections: 0.077
• Weighted residual factors for significantly intense reflections: 0.156
• Weighted residual factors for all reflections included in the refinement: 0.1992
• Goodness-of-fit parameter for all reflections included in the refinement: 0.749
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No