Information card for entry 7703639

Structure parameters

• Formula: C32 H20 Al N7 O9
• Calculated formula: C32 H20 Al N7 O9
• SMILES: [Al]1234(Oc5c(C=[N]4c4cccc6ccc[n]3c46)cc(N(=O)=O)cc5)Oc3c(C=[N]2c2c4[n]1cccc4ccc2)cc(N(=O)=O)cc3.N(=O)(=O)[O-]
• Title of publication: The development of two fluorescent chemosensors for the selective detection of Zn²⁺ and Al³⁺ ions in a quinoline platform by tuning the substituents in the receptor part: elucidation of the structures of the metal-bound chemosensors and biological studies.
• Authors of publication: Ghorai, Pravat; Pal, Kunal; Karmakar, Parimal; Saha, Amrita
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 15
• Pages of publication: 4758 - 4773
• a: 12.5503 ± 0.0009 Å
• b: 14.1977 ± 0.001 Å
• c: 16.88 ± 0.0012 Å
• α: 90°
• β: 101.622 ± 0.002°
• γ: 90°
• Cell volume: 2946.1 ± 0.4 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1071
• Residual factor for significantly intense reflections: 0.0936
• Weighted residual factors for significantly intense reflections: 0.3187
• Weighted residual factors for all reflections included in the refinement: 0.3438
• Goodness-of-fit parameter for all reflections included in the refinement: 1.51
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No