Information card for entry 7120571

Structure parameters

• Formula: C36 H26 N2
• Calculated formula: C36 H26 N2
• Title of publication: A highly luminescent entangled metal-organic framework based on pyridine-substituted tetraphenylethene for efficient pesticide detection
• Authors of publication: Tao, Chen-Lei; Chen, Bin; Liu, Xun-Gao; Zhou, Li-Jiao; Zhu, Xiao-Li; Cao, Jun; Gu, Zhi-Guo; Zhao, Zujin; Shen, Liang; Tang, Ben Zhong
• Journal of publication: Chem. Commun.
• Year of publication: 2017
• a: 5.6957 ± 0.0004 Å
• b: 34.431 ± 0.002 Å
• c: 13.1466 ± 0.0009 Å
• α: 90°
• β: 90.142 ± 0.002°
• γ: 90°
• Cell volume: 2578.2 ± 0.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 3
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.1332
• Residual factor for significantly intense reflections: 0.1076
• Weighted residual factors for significantly intense reflections: 0.2778
• Weighted residual factors for all reflections included in the refinement: 0.2984
• Goodness-of-fit parameter for all reflections included in the refinement: 1.199
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No