Information card for entry 4132198

Structure parameters

• Formula: C36 H24 N2 O2
• Calculated formula: C36 H24 N2 O2
• SMILES: Oc1ccc(C(=C(c2ccc(C(=C(C#N)C#N)c3ccccc3)cc2)c2ccccc2)c2ccc(O)cc2)cc1
• Title of publication: Redox-Active AIEgen-Derived Plasmonic and Fluorescent Core@Shell Nanoparticles for Multimodality Bioimaging.
• Authors of publication: He, Xuewen; Zhao, Zheng; Xiong, Ling-Hong; Gao, Peng Fei; Peng, Chen; Li, Rong Sheng; Xiong, Yu; Li, Zhi; Sung, Herman H.-Y.; Williams, Ian D.; Kwok, Ryan T. K.; Lam, Jacky W. Y.; Huang, Cheng Zhi; Ma, Nan; Tang, Ben Zhong
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2018
• Journal volume: 140
• Journal issue: 22
• Pages of publication: 6904 - 6911
• a: 9.454 ± 0.0005 Å
• b: 10.1497 ± 0.0005 Å
• c: 15.3519 ± 0.0008 Å
• α: 75.573 ± 0.004°
• β: 86.417 ± 0.004°
• γ: 89.725 ± 0.004°
• Cell volume: 1423.77 ± 0.13 ų
• Cell temperature: 220 ± 0.1 K
• Ambient diffraction temperature: 220 ± 0.1 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: 0.0435
• Residual factor for significantly intense reflections: 0.0376
• Weighted residual factors for significantly intense reflections: 0.0978
• Weighted residual factors for all reflections included in the refinement: 0.102
• Goodness-of-fit parameter for all reflections included in the refinement: 1.004
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No