Information card for entry 7207853

Structure parameters

• Formula: C16 H10 Cu I2 N O4
• Calculated formula: C16 H10 Cu I2 N O4
• Title of publication: The effect of carboxylate and N,N′-ditopic ligand lengths on the structures of copper and zinc coordination polymers
• Authors of publication: Burrows, Andrew D.; Mahon, Mary F.; Raithby, Paul R.; Warren, Anna J.; Teat, Simon J.; Warren, John E.
• Journal of publication: CrystEngComm
• Year of publication: 2012
• Journal volume: 14
• Journal issue: 10
• Pages of publication: 3658
• a: 18.775 ± 0.001 Å
• b: 18.775 ± 0.001 Å
• c: 19.672 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6934.4 ± 1.2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 88
• Hermann-Mauguin space group symbol: I 41/a :2
• Hall space group symbol: -I 4ad
• Residual factor for all reflections: 0.1125
• Residual factor for significantly intense reflections: 0.0668
• Weighted residual factors for significantly intense reflections: 0.175
• Weighted residual factors for all reflections included in the refinement: 0.189
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No