Information card for entry 7221787

Structure parameters

• Formula: C52 H40 Cu4 N16 O18 S4
• Calculated formula: C52 H40 Cu4 N16 O18 S4
• Title of publication: Structural diversities in Cu(i) and Ag(i) sulfonate coordination polymers and their anion exchange properties
• Authors of publication: Singh, Suryabhan; Karthik, Rajendran
• Journal of publication: CrystEngComm
• Year of publication: 2015
• Journal volume: 17
• Journal issue: 38
• Pages of publication: 7363
• a: 10.645 ± 0.002 Å
• b: 15.367 ± 0.003 Å
• c: 19.59 ± 0.004 Å
• α: 80.844 ± 0.01°
• β: 83.69 ± 0.011°
• γ: 85.182 ± 0.01°
• Cell volume: 3137.3 ± 1.1 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: 0.119
• Residual factor for significantly intense reflections: 0.0588
• Weighted residual factors for significantly intense reflections: 0.1407
• Weighted residual factors for all reflections included in the refinement: 0.1691
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No