Information card for entry 7245839

Structure parameters

• Formula: C44 H34 Cd3 N4 O18
• Calculated formula: C44 H34 Cd3 N4 O18
• Title of publication: Improvement of the fluorescent sensing biomarker 3-nitrotyrosine for a new luminescent coordination polymer by size regulation
• Authors of publication: Geng, Jun; Lin, Hongyan; Li, Xiaohui; Lu, Junjun; Wang, XiuLi
• Journal of publication: CrystEngComm
• Year of publication: 2022
• a: 9.7026 ± 0.0012 Å
• b: 9.9293 ± 0.0013 Å
• c: 12.8415 ± 0.0016 Å
• α: 100.645 ± 0.002°
• β: 99.837 ± 0.002°
• γ: 116.544 ± 0.002°
• Cell volume: 1041.5 ± 0.2 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: 0.0844
• Residual factor for significantly intense reflections: 0.0501
• Weighted residual factors for significantly intense reflections: 0.1202
• Weighted residual factors for all reflections included in the refinement: 0.1373
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Diffraction radiation X-ray symbol: K-L~3~
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No