Information card for entry 4134481

Structure parameters

• Formula: F0.8 H6.4 K0.03 N1.57 O2.4 P0.8
• Calculated formula: F0.8 H6.4 K0.0304 N1.5696 O2.4 P0.8
• Title of publication: Solid-State Nonlinear Optical Switch with the Widest Switching Temperature Range Owing to Its Continuously Tunable <i>T</i>_c.
• Authors of publication: Pan, Chun-Ya; Yang, Xin-Rui; Xiong, Lin; Lu, Zhong-Wei; Zhen, Bo-Yu; Sui, Xin; Deng, Xue-Bin; Chen, Ling; Wu, Li-Ming
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2020
• Journal volume: 142
• Journal issue: 13
• Pages of publication: 6423 - 6431
• a: 7.9299 ± 0.0003 Å
• b: 11.2968 ± 0.0004 Å
• c: 6.0169 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 539.01 ± 0.03 ų
• Cell temperature: 260 ± 2 K
• Ambient diffraction temperature: 260 ± 2 K
• Number of distinct elements: 6
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0462
• Residual factor for significantly intense reflections: 0.0416
• Weighted residual factors for significantly intense reflections: 0.1119
• Weighted residual factors for all reflections included in the refinement: 0.1172
• Goodness-of-fit parameter for all reflections included in the refinement: 0.975
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No