Information card for entry 7252067

Structure parameters

• Formula: C20 H42 Cu5 I7 N4 O6
• Calculated formula: C20 H42 Cu5 I7 N4 O6
• Title of publication: Copper(i) iodide complexes based on [Cu5I7]2− units and cationic organic ligands for X-ray scintillation and imaging
• Authors of publication: Wu, Qian; Lu, Zhen-Zhong; Zhang, Rui
• Journal of publication: CrystEngComm
• Year of publication: 2026
• a: 8.8697 ± 0.0007 Å
• b: 11.6281 ± 0.0009 Å
• c: 21.0229 ± 0.0016 Å
• α: 105.204 ± 0.004°
• β: 90.63 ± 0.005°
• γ: 106.351 ± 0.005°
• Cell volume: 1999.3 ± 0.3 ų
• Cell temperature: 223 K
• Ambient diffraction temperature: 223 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: 0.0586
• Residual factor for significantly intense reflections: 0.0498
• Weighted residual factors for significantly intense reflections: 0.1378
• Weighted residual factors for all reflections included in the refinement: 0.1453
• Goodness-of-fit parameter for all reflections included in the refinement: 1.006
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No