Information card for entry 7708554

Structure parameters

• Formula: C24 H34 N2 O12 Pd
• Calculated formula: C24 H34 N2 O12 Pd
• Title of publication: A selective fluorescent probe for GadoliniumIII in water based on a PdII -preorganized chromone-receptor
• Authors of publication: Paderni, Daniele; Giorgi , Luca; Macedi, Eleonora; Formica, Mauro; Paoli, Paola; Rossi, Patrizia; Fusi, Vieri
• Journal of publication: Dalton Transactions
• Year of publication: 2021
• a: 13.899 ± 0.0005 Å
• b: 9.2755 ± 0.0005 Å
• c: 20.2093 ± 0.0019 Å
• α: 90°
• β: 100.88 ± 0.005°
• γ: 90°
• Cell volume: 2558.6 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0926
• Residual factor for significantly intense reflections: 0.0606
• Weighted residual factors for significantly intense reflections: 0.1317
• Weighted residual factors for all reflections included in the refinement: 0.1498
• Goodness-of-fit parameter for all reflections included in the refinement: 1.063
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No