Information card for entry 7720737

Structure parameters

• Chemical name: EDTAQUIN
• Formula: C28 H28 N6 O6
• Calculated formula: C28 H28 N6 O6
• Title of publication: Rational design and evaluation of the sensing mechanism of a europium(III)-based luminescent turn-ON chemosensor for citrate
• Authors of publication: Shaw, Ashwini Kumari; Shukla, Nitin; Patra, Ashis Kumar
• Journal of publication: Dalton Transactions
• Year of publication: 2026
• a: 11.0077 ± 0.0007 Å
• b: 7.3991 ± 0.0005 Å
• c: 15.8713 ± 0.0011 Å
• α: 90°
• β: 106.143 ± 0.002°
• γ: 90°
• Cell volume: 1241.7 ± 0.14 ų
• Cell temperature: 273.15 K
• Ambient diffraction temperature: 273.15 K
• Number of distinct elements: 4
• 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: 0.0902
• Residual factor for significantly intense reflections: 0.0812
• Weighted residual factors for significantly intense reflections: 0.153
• Weighted residual factors for all reflections included in the refinement: 0.157
• Goodness-of-fit parameter for all reflections included in the refinement: 1.224
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No