Information card for entry 7061472

Structure parameters

• Formula: C45 H32 Cl N3
• Calculated formula: C45 H32 Cl N3
• Title of publication: Differential detection of strong acids in weak acids: a combination of a benzimidazole-carbazole backbone with AIE luminophores as highly sensitive and selective turn-on fluorescent probes
• Authors of publication: Lin, Pei-Chi; Lin, Yu-Ting; Liu, Kuan-Ting; Chen, Meng-Sin; Zhang, Yong-Yun; Li, Jie-Cheng; Leung, Man-kit
• Journal of publication: New Journal of Chemistry
• Year of publication: 2022
• Journal volume: 46
• Journal issue: 21
• Pages of publication: 10317 - 10327
• a: 9.1375 ± 0.0011 Å
• b: 11.3158 ± 0.0013 Å
• c: 18.3796 ± 0.0013 Å
• α: 77.293 ± 0.008°
• β: 86.737 ± 0.008°
• γ: 81.617 ± 0.01°
• Cell volume: 1833.5 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1042
• Residual factor for significantly intense reflections: 0.0685
• Weighted residual factors for significantly intense reflections: 0.1694
• Weighted residual factors for all reflections included in the refinement: 0.2063
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No