Information card for entry 7246810

Structure parameters

• Formula: C52 H48 Cd2 N4 O19
• Calculated formula: C52 H48 Cd2 N4 O19
• Title of publication: The high fluorescence sensitivity property and quenching mechanism of one-dimensional Cd-HCIA-1 sensor for nitrobenzene.
• Authors of publication: Song, Xiaoming; Dong, Wenzhuo; Hou, Xiufang; Zhao, Qingxia; Zhang, Zhuangzhuang; Ren, Yixia
• Journal of publication: Physical chemistry chemical physics : PCCP
• Year of publication: 2023
• Journal volume: 25
• Journal issue: 21
• Pages of publication: 14907 - 14917
• a: 10.116 ± 0.003 Å
• b: 10.401 ± 0.004 Å
• c: 13.707 ± 0.005 Å
• α: 92.118 ± 0.005°
• β: 106.385 ± 0.005°
• γ: 116.737 ± 0.005°
• Cell volume: 1212.9 ± 0.7 ų
• Cell temperature: 296.15 K
• Ambient diffraction temperature: 296.15 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: 0.0332
• Residual factor for significantly intense reflections: 0.0289
• Weighted residual factors for significantly intense reflections: 0.0713
• Weighted residual factors for all reflections included in the refinement: 0.0736
• Goodness-of-fit parameter for all reflections included in the refinement: 1.062
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No