Information card for entry 7134812

Structure parameters

• Formula: C24 H17 Br N2 O2
• Calculated formula: C24 H17 Br N2 O2
• Title of publication: Water-driven modulation of multiresponsive properties in acylhydrazone-based crystals.
• Authors of publication: Manoharan, Deepak; Bhowmik, Aritra; Mishra, Manish Kumar; Ghosh, Soumyajit
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2025
• Journal volume: 61
• Journal issue: 65
• Pages of publication: 12139 - 12142
• a: 4.723 ± 0.003 Å
• b: 12.844 ± 0.01 Å
• c: 32.01 ± 0.02 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1942 ± 2 ų
• Cell temperature: 300 K
• Ambient diffraction temperature: 300 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0842
• Residual factor for significantly intense reflections: 0.0421
• Weighted residual factors for significantly intense reflections: 0.0718
• Weighted residual factors for all reflections included in the refinement: 0.0859
• Goodness-of-fit parameter for all reflections included in the refinement: 1.011
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No