Information card for entry 7712123

Structure parameters

• Formula: C56 H32 Cu2 I2 N8 O8
• Calculated formula: C56 H32 Cu2 I2 N8 O8
• Title of publication: Luminescent MOFs constructed by using butterfly-like AIE ligands.
• Authors of publication: Dong, Pan-Pan; Liu, Yuan-Yuan; Peng, Qiu-Chen; Li, Hai-Yang; Li, Kai; Zang, Shuang-Quan; Tang, Ben Zhong
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2023
• Journal volume: 52
• Journal issue: 7
• Pages of publication: 1913 - 1918
• a: 30.9478 ± 0.0005 Å
• b: 8.7794 ± 0.0002 Å
• c: 12.2189 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3319.91 ± 0.12 ų
• Cell temperature: 199.99 ± 0.1 K
• Ambient diffraction temperature: 200 K
• Number of distinct elements: 6
• Space group number: 55
• Hermann-Mauguin space group symbol: P b a m
• Hall space group symbol: -P 2 2ab
• Residual factor for all reflections: 0.0602
• Residual factor for significantly intense reflections: 0.0512
• Weighted residual factors for significantly intense reflections: 0.1486
• Weighted residual factors for all reflections included in the refinement: 0.1565
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No