Information card for entry 7717114

Structure parameters

• Formula: C69 H71 N8 O16 Zn2
• Calculated formula: C60 H43 N4 O12 Zn2
• Title of publication: Construction of 2D zinc(II) MOFs with tricarboxylate and N-donor mixed ligands for multiresponsive luminescence sensor and CO2 adsorption
• Authors of publication: Khotchasanthong, Kenika; Chinchan, Kunlanit; Kongpatpanich, Kanokwan; Pinyo, Waraporn; Kielar, Filip; Dungkeaw, Winya; Sukwattanasinitt, Mongkol; Laksee, Sakchai; Chainok, Kittipong
• Journal of publication: Dalton Transactions
• Year of publication: 2024
• a: 14.588 ± 0.0004 Å
• b: 16.0895 ± 0.0004 Å
• c: 16.5097 ± 0.0004 Å
• α: 65.051 ± 0.001°
• β: 86.836 ± 0.001°
• γ: 89.483 ± 0.001°
• Cell volume: 3507.65 ± 0.16 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0643
• Residual factor for significantly intense reflections: 0.0608
• Weighted residual factors for significantly intense reflections: 0.1957
• Weighted residual factors for all reflections included in the refinement: 0.201
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Diffraction radiation X-ray symbol: K-L~3~
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No