Information card for entry 7231867

Structure parameters

• Formula: F4 K Tm
• Calculated formula: F4 K Tm
• Title of publication: Remarkable pressure-induced emission enhancement based on intermolecular charge transfer in halogen bond-driven dual-component co-crystals.
• Authors of publication: Li, Aisen; Wang, Jing; Liu, Yingjie; Xu, Shuping; Chu, Ning; Geng, Yijia; Li, Bao; Xu, Bin; Cui, Haining; Xu, Weiqing
• Journal of publication: Physical chemistry chemical physics : PCCP
• Year of publication: 2018
• Journal volume: 20
• Journal issue: 48
• Pages of publication: 30297 - 30303
• a: 14.087 ± 0.002 Å
• b: 14.087 ± 0.002 Å
• c: 10.146 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 1743.7 ± 0.4 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 3
• Space group number: 145
• Hermann-Mauguin space group symbol: P 32
• Hall space group symbol: P 32
• Residual factor for all reflections: 0.031
• Residual factor for significantly intense reflections: 0.0301
• Weighted residual factors for significantly intense reflections: 0.0385
• Weighted residual factors for all reflections included in the refinement: 0.0386
• Goodness-of-fit parameter for significantly intense reflections: 1.73
• Goodness-of-fit parameter for all reflections included in the refinement: 1.71
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.4 Å
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No