Information card for entry 7712122

Structure parameters

• Formula: C62 H42 Cl4 Cu2 I2 N10 O8
• Calculated formula: C62 H42 Cl3 Cu2 I2 N10 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: 27.2643 ± 0.0002 Å
• b: 9.6798 ± 0.0001 Å
• c: 11.3185 ± 0.0001 Å
• α: 90°
• β: 90.506 ± 0.001°
• γ: 90°
• Cell volume: 2986.98 ± 0.05 ų
• Cell temperature: 200 K
• Ambient diffraction temperature: 200 K
• Number of distinct elements: 7
• Space group number: 12
• Hermann-Mauguin space group symbol: C 1 2/m 1
• Hall space group symbol: -C 2y
• Residual factor for all reflections: 0.0501
• Residual factor for significantly intense reflections: 0.0496
• Weighted residual factors for significantly intense reflections: 0.1381
• Weighted residual factors for all reflections included in the refinement: 0.1386
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No