Information card for entry 7226527

Structure parameters

• Common name: [BQL]2[Cu5I7]
• Chemical name: compound 4
• Formula: C32 H28 Cu5 I7 N2
• Calculated formula: C32 H28 Cu5 I7 N2
• Title of publication: Spontaneous Chiral Resolution and Hierarchical Directing Effects of Two-winged Propeller-like SDAs on the Construction of Noncentrosymmetric Iodoargentates/Iodocuprates
• Authors of publication: Hao, Pengfei; Qiao, Yanrong; yu, tanlai; shen, junju; Dai, Dongting; fu, yunlong
• Journal of publication: RSC Adv.
• Year of publication: 2016
• a: 27.5988 ± 0.0008 Å
• b: 10.9911 ± 0.0003 Å
• c: 27.3011 ± 0.0007 Å
• α: 90°
• β: 105.089 ± 0.003°
• γ: 90°
• Cell volume: 7996 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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: 0.049
• Residual factor for significantly intense reflections: 0.0341
• Weighted residual factors for significantly intense reflections: 0.0627
• Weighted residual factors for all reflections included in the refinement: 0.0678
• Goodness-of-fit parameter for all reflections included in the refinement: 1.092
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No