Information card for entry 1575409

Structure parameters

• Chemical name: Ni_S
• Formula: C58 H40 N8 Ni O4
• Calculated formula: C58 H40 N8 Ni O4
• Title of publication: Water-stable Ni(II)-MOFs as ratiometric fluorescent probes for the detection of perfluorocarboxylic acids.
• Authors of publication: Zhang, Kai-Yang; Qiu, Zhao-Feng; Wang, Fang-Fang; Guo, Xiao-Ru; Zhao, Yue; Cui, Pei-Pei; Sun, Wei-Yin
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2025
• Journal volume: 54
• Journal issue: 35
• Pages of publication: 13308 - 13316
• a: 12.7302 ± 0.0015 Å
• b: 14.8681 ± 0.0015 Å
• c: 15.5867 ± 0.0017 Å
• α: 78.734 ± 0.004°
• β: 89.549 ± 0.005°
• γ: 66.505 ± 0.004°
• Cell volume: 2645.4 ± 0.5 ų
• Cell temperature: 193 K
• Ambient diffraction temperature: 193 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: 0.1942
• Residual factor for significantly intense reflections: 0.1178
• Weighted residual factors for significantly intense reflections: 0.308
• Weighted residual factors for all reflections included in the refinement: 0.3541
• Goodness-of-fit parameter for all reflections included in the refinement: 1.071
• Diffraction radiation wavelength: 1.34139 Å
• Diffraction radiation type: GaKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No