Information card for entry 7063632

Structure parameters

• Formula: C38 H41 Br N4 O3
• Calculated formula: C38 H41 Br N4 O3
• Title of publication: Fabrication of a novel AIE active chemosensor for selective detection of Pd(ii) and picric acid: extended detection in the HeLa cancer cell line
• Authors of publication: Das, Susmita; Das, Manik; Biswas, Raju; Das, Uttam Kumar; Laha, Soumik; Samanta, Bidhan Chandra; Choudhuri, Indranil; Bhattacharya, Nandan; Maity, Tithi
• Journal of publication: New Journal of Chemistry
• Year of publication: 2025
• Journal volume: 49
• Journal issue: 10
• Pages of publication: 4021 - 4034
• a: 11.899 ± 0.004 Å
• b: 12.929 ± 0.004 Å
• c: 13.569 ± 0.005 Å
• α: 63.285 ± 0.01°
• β: 70.822 ± 0.011°
• γ: 70.907 ± 0.01°
• Cell volume: 1720.9 ± 1 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1475
• Residual factor for significantly intense reflections: 0.0922
• Weighted residual factors for significantly intense reflections: 0.2307
• Weighted residual factors for all reflections included in the refinement: 0.2625
• Goodness-of-fit parameter for all reflections included in the refinement: 1.084
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No