Information card for entry 7238094

Structure parameters

• Formula: C7 H6 Cu2 I2 N2
• Calculated formula: C7 H6 Cu2 I2 N2
• Title of publication: Solvent control in the hydrothermal synthesis of two copper(i) iodide‒benzimidazole coordination polymers
• Authors of publication: Wu, Tao; Li, Dan; Ng, Seik Weng
• Journal of publication: CrystEngComm
• Year of publication: 2005
• Journal volume: 7
• Journal issue: 84
• Pages of publication: 514
• a: 15.8807 ± 0.0012 Å
• b: 4.1476 ± 0.0003 Å
• c: 17.2672 ± 0.0013 Å
• α: 90°
• β: 111.929 ± 0.001°
• γ: 90°
• Cell volume: 1055.05 ± 0.14 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0488
• Residual factor for significantly intense reflections: 0.0373
• Weighted residual factors for significantly intense reflections: 0.0954
• Weighted residual factors for all reflections included in the refinement: 0.1135
• Goodness-of-fit parameter for all reflections included in the refinement: 1.105
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No