Information card for entry 7712125

Structure parameters

• Formula: C28 H16 N4 O4
• Calculated formula: C28 H16 N4 O4
• SMILES: O1c2ccc3c(c(Oc4nc(Oc5ccc6c(c5)c(Oc5nc1cnc5)ccc6)cnc4)ccc3)c2
• 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: 9.7538 ± 0.0016 Å
• b: 11.407 ± 0.002 Å
• c: 11.4194 ± 0.0019 Å
• α: 103.712 ± 0.007°
• β: 113.415 ± 0.006°
• γ: 100.779 ± 0.007°
• Cell volume: 1074.9 ± 0.3 ų
• Cell temperature: 273.15 K
• Ambient diffraction temperature: 273.15 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0697
• Residual factor for significantly intense reflections: 0.0422
• Weighted residual factors for significantly intense reflections: 0.0953
• Weighted residual factors for all reflections included in the refinement: 0.109
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No