Information card for entry 1573878

Structure parameters

• Formula: C20 H18 Br4 N2 O2
• Calculated formula: C20 H18 Br4 N2 O2
• Title of publication: A robust PET-based chiral Schiff base molecular probe for recognition of Hg²⁺ and Pb²⁺ and its application in live cell imaging.
• Authors of publication: Jeba Silviya, S. Benita; Ruphina Maragatham, S. Michlin; Andrews, S. G. Jebastin; Bhuvanesh, Nattamai S. P.; Jebaraj, J. Winfred; Balakrishnan, Chithiraivel
• Journal of publication: Analytical methods : advancing methods and applications
• Year of publication: 2025
• Journal volume: 17
• Journal issue: 10
• Pages of publication: 2342 - 2354
• a: 15.9413 ± 0.0008 Å
• b: 9.245 ± 0.0005 Å
• c: 16.0151 ± 0.0008 Å
• α: 90°
• β: 110.54 ± 0.002°
• γ: 90°
• Cell volume: 2210.2 ± 0.2 ų
• Cell temperature: 110 K
• Ambient diffraction temperature: 110 K
• Number of distinct elements: 5
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/n 1
• Hall space group symbol: -P 2yac
• Residual factor for all reflections: 0.0246
• Residual factor for significantly intense reflections: 0.0187
• Weighted residual factors for significantly intense reflections: 0.0415
• Weighted residual factors for all reflections included in the refinement: 0.043
• Goodness-of-fit parameter for all reflections included in the refinement: 1.051
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No