Information card for entry 1573218

Structure parameters

• Formula: C34 H47 Cu4 I6 N9 O2
• Calculated formula: C34 H47 Cu4 I6 N9 O2
• Title of publication: Strongly photoluminescent and radioluminescent copper(i) iodide hybrid materials made of coordinated ionic chains.
• Authors of publication: Chen, Jingwen; Zhou, Kang; Li, Jingbai; Xu, Guozhong; Hei, Xiuze; Li, Jing
• Journal of publication: Chemical science
• Year of publication: 2025
• Journal volume: 16
• Journal issue: 3
• Pages of publication: 1106 - 1114
• a: 10.1107 ± 0.0015 Å
• b: 11.2297 ± 0.0018 Å
• c: 11.9172 ± 0.0017 Å
• α: 73.93 ± 0.006°
• β: 67.168 ± 0.005°
• γ: 71.862 ± 0.006°
• Cell volume: 1166.1 ± 0.3 ų
• Cell temperature: 200 K
• Ambient diffraction temperature: 200 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: 0.0554
• Residual factor for significantly intense reflections: 0.0436
• Weighted residual factors for significantly intense reflections: 0.0969
• Weighted residual factors for all reflections included in the refinement: 0.1023
• Goodness-of-fit parameter for all reflections included in the refinement: 1.15
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No