Information card for entry 4517621

Structure parameters

• Formula: C23 H16 Br Cl Eu N3 O7
• Calculated formula: C23 H16 Br Cl Eu N3 O7
• Title of publication: Luminescent Europium(III) 'Turn-ON' Sensor for G-series Chemical Warfare Simulants: A Mechanistic Investigation.
• Authors of publication: Gupta, Kritika; Patra, Ashis K.
• Journal of publication: ACS sensors
• Year of publication: 2020
• a: 24.49 ± 0.004 Å
• b: 31.655 ± 0.005 Å
• c: 8.3979 ± 0.0012 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6510.3 ± 1.7 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 7
• Space group number: 56
• Hermann-Mauguin space group symbol: P c c n
• Hall space group symbol: -P 2ab 2ac
• Residual factor for all reflections: 0.0815
• Residual factor for significantly intense reflections: 0.0584
• Weighted residual factors for significantly intense reflections: 0.1369
• Weighted residual factors for all reflections included in the refinement: 0.1515
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No