Information card for entry 7156492

Structure parameters

• Formula: C22 H17 N5
• Calculated formula: C22 H17 N5
• Title of publication: Triazole-imidazole (TA-IM) derivatives as ultrafast fluorescent probes for selective Ag⁺ detection.
• Authors of publication: Lai, Qi; Liu, Qing; He, Ying; Zhao, Kai; Wei, Chiyu; Wojtas, Lukasz; Shi, Xiaodong; Song, Zhiguang
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2018
• Journal volume: 16
• Journal issue: 42
• Pages of publication: 7801 - 7805
• a: 11.7774 ± 0.0002 Å
• b: 22.0334 ± 0.0004 Å
• c: 14.1047 ± 0.0003 Å
• α: 90°
• β: 104.437 ± 0.001°
• γ: 90°
• Cell volume: 3544.54 ± 0.12 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0469
• Residual factor for significantly intense reflections: 0.0352
• Weighted residual factors for significantly intense reflections: 0.0786
• Weighted residual factors for all reflections included in the refinement: 0.0844
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No