Information card for entry 1570979

Structure parameters

• Formula: C31 H23 Br N2 O
• Calculated formula: C31 H23 Br N2 O
• Title of publication: Multi-site isomerization of synergistically regulated stimuli-responsive AIE materials toward multi-level decryption.
• Authors of publication: Zhong, Weiren; Zhang, Jianyu; Lin, Yuting; Li, Shouji; Yang, Yalan; Wang, Wen-Jin; Si, Chuanling; Kühn, Fritz E; Zhao, Zheng; Cai, Xu-Min; Tang, Ben Zhong
• Journal of publication: Chemical science
• Year of publication: 2024
• Journal volume: 15
• Journal issue: 11
• Pages of publication: 3920 - 3927
• a: 19.02 ± 0.03 Å
• b: 13.3 ± 0.018 Å
• c: 9.799 ± 0.014 Å
• α: 90°
• β: 100.93 ± 0.03°
• γ: 90°
• Cell volume: 2434 ± 6 ų
• Cell temperature: 296.15 K
• Ambient diffraction temperature: 296.15 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.2126
• Residual factor for significantly intense reflections: 0.0952
• Weighted residual factors for significantly intense reflections: 0.1768
• Weighted residual factors for all reflections included in the refinement: 0.2291
• Goodness-of-fit parameter for all reflections included in the refinement: 1.065
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No