Information card for entry 7247937

Structure parameters

• Formula: C50 H36 N2 O5 Zn
• Calculated formula: C50 H36 N2 O5 Zn
• Title of publication: Facile construction of an anthracene-decorated highly luminescent coordination polymer for the selective detection of explosive nitroaromatics and the mutagenic pollutant TNP
• Authors of publication: Hossain, Ersad; Hazra, Abhijit; Datta, Sourav; Khan, Samim; Pramanik, Samit; Banerjee, Priyabrata; Mir, Mohammad Hedayetullah; Mukhopadhyay, Subrata
• Journal of publication: RSC Advances
• Year of publication: 2024
• Journal volume: 14
• Journal issue: 1
• Pages of publication: 397 - 404
• a: 6.011 ± 0.003 Å
• b: 15.789 ± 0.008 Å
• c: 21.392 ± 0.011 Å
• α: 73.242 ± 0.006°
• β: 83.793 ± 0.007°
• γ: 86.176 ± 0.006°
• Cell volume: 1931.3 ± 1.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293.15 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: 0.0555
• Residual factor for significantly intense reflections: 0.0409
• Weighted residual factors for significantly intense reflections: 0.0903
• Weighted residual factors for all reflections included in the refinement: 0.0967
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No