Information card for entry 7205705

Structure parameters

• Formula: C38 H49 Cu2 I2 N O S4
• Calculated formula: C38 H49 Cu2 I2 N O S4
• Title of publication: Cuprous iodide coordination polymers (CuI)x(L)y·z(solvent) built on linear thioether linkers
• Authors of publication: Zhang, Jun; Xue, Yun-Shan; Li, Yi-Zhi; Du, Hong-Bin; You, Xiao-Zeng
• Journal of publication: CrystEngComm
• Year of publication: 2011
• Journal volume: 13
• Journal issue: 7
• Pages of publication: 2578
• a: 24.998 ± 0.006 Å
• b: 8.734 ± 0.002 Å
• c: 22.402 ± 0.006 Å
• α: 90°
• β: 101.507 ± 0.002°
• γ: 90°
• Cell volume: 4793 ± 2 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 2 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0701
• Residual factor for significantly intense reflections: 0.0492
• Weighted residual factors for significantly intense reflections: 0.1013
• Weighted residual factors for all reflections included in the refinement: 0.1047
• Goodness-of-fit parameter for all reflections included in the refinement: 1.081
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No