Information card for entry 1554656

Structure parameters

• Chemical name: TPh-TM
• Formula: C24 H26
• Calculated formula: C24 H26
• SMILES: c1(cc(c(cc1c1ccc(c2c(cc(c(c2)C)C)C)cc1)C)C)C
• Title of publication: Drawing a clear mechanistic picture for the aggregation-induced emission process
• Authors of publication: Zhang, Haoke; Liu, Junkai; Du, Lili; Ma, Chao; Leung, Nelson L. C.; Niu, Yingli; Qin, Anjun; Sun, Jingzhi; Peng, Qian; Sung, Herman H. Y.; Williams, Ian D.; Kwok, Ryan T. K.; Lam, Jacky W. Y.; Wong, Kam Sing; Phillips, David Lee; Tang, Ben Zhong
• Journal of publication: Materials Chemistry Frontiers
• Year of publication: 2019
• Journal volume: 3
• Journal issue: 6
• Pages of publication: 1143
• a: 7.9294 ± 0.0008 Å
• b: 7.3834 ± 0.0007 Å
• c: 16.2178 ± 0.0015 Å
• α: 90°
• β: 90.745 ± 0.008°
• γ: 90°
• Cell volume: 949.41 ± 0.16 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293.15 K
• Number of distinct elements: 2
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0686
• Residual factor for significantly intense reflections: 0.0497
• Weighted residual factors for significantly intense reflections: 0.1315
• Weighted residual factors for all reflections included in the refinement: 0.1493
• Goodness-of-fit parameter for all reflections included in the refinement: 1.063
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No