Information card for entry 7061877

Structure parameters

• Formula: C24 H24.11 Br F3 N3 O13.05 S Tb
• Calculated formula: C24 H24.11 Br F3 N3 O13.055 S Tb
• Title of publication: A luminescent terbium(iii) probe as an efficient ‘Turn-ON’ sensor for dipicolinic acid, a Bacillus Anthracis biomarker
• Authors of publication: Yadav, Usha; Abbas, Zafar; Butcher, Ray J.; Patra, Ashis K.
• Journal of publication: New Journal of Chemistry
• Year of publication: 2022
• Journal volume: 46
• Journal issue: 38
• Pages of publication: 18285 - 18294
• a: 24.03 ± 0.002 Å
• b: 32.02 ± 0.003 Å
• c: 8.3827 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6450 ± 1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• 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: 0.0539
• Residual factor for significantly intense reflections: 0.0378
• Weighted residual factors for significantly intense reflections: 0.077
• Weighted residual factors for all reflections included in the refinement: 0.086
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No