Information card for entry 1573836

Structure parameters

• Formula: C18 H33 F6 N2 O6 P
• Calculated formula: C18 H33 F6 N2 O6 P
• SMILES: [P](F)(F)(F)(F)(F)[F-].O1CCOCCOCCOCCOCCOCC1.[NH3+]Cc1ccncc1
• Title of publication: Thermal-responsive luminescence/dielectric responses with reversibly shifted light emissions.
• Authors of publication: Zhu, Ming; Huang, Pei-Zhi; Li, Lin-Mei; Yang, Yi-Xuan; Pan, Lei; Wang, Zhi-Jie; Ni, Hao-Fei; Zhang, Feng-Wen; Teri, Gele; Zhang, Zhi-Xu; Liu, Zunqi; Fu, Da-Wei; Zhang, Yi
• Journal of publication: Chemical science
• Year of publication: 2025
• Journal volume: 16
• Journal issue: 9
• Pages of publication: 4101 - 4108
• a: 11.994 ± 0.005 Å
• b: 10.463 ± 0.003 Å
• c: 19.815 ± 0.009 Å
• α: 90°
• β: 100.89 ± 0.02°
• γ: 90°
• Cell volume: 2441.9 ± 1.7 ų
• Cell temperature: 403 K
• Ambient diffraction temperature: 403 K
• Number of distinct elements: 6
• 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: 0.2635
• Residual factor for significantly intense reflections: 0.1381
• Weighted residual factors for significantly intense reflections: 0.2825
• Weighted residual factors for all reflections included in the refinement: 0.3326
• Goodness-of-fit parameter for all reflections included in the refinement: 0.998
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No