Information card for entry 7130317

Structure parameters

• Formula: C69.5 H72.25 N3 O9.5
• Calculated formula: C69.5 H65 N3 O9.5
• Title of publication: Polyamine receptors containing anthracene as fluorescent probes for ketoprofen in H₂O/EtOH solution.
• Authors of publication: Romano, Giammarco Maria; Mummolo, Liviana; Savastano, Matteo; Paoli, Paola; Rossi, Patrizia; Prodi, Luca; Bencini, Andrea
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2022
• Journal volume: 58
• Journal issue: 50
• Pages of publication: 7022 - 7025
• a: 12.1823 ± 0.0003 Å
• b: 13.0452 ± 0.0004 Å
• c: 19.3857 ± 0.0005 Å
• α: 101.4 ± 0.001°
• β: 99.006 ± 0.001°
• γ: 101.858 ± 0.001°
• Cell volume: 2892.47 ± 0.14 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 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: 0.0703
• Residual factor for significantly intense reflections: 0.0631
• Weighted residual factors for significantly intense reflections: 0.1692
• Weighted residual factors for all reflections included in the refinement: 0.1763
• Goodness-of-fit parameter for all reflections included in the refinement: 1.012
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No