Information card for entry 1566828

Structure parameters

• Formula: C13 H11.5 F3 N0.5 S0.5 Sb0.5
• Calculated formula: C13 H11.5 F3 N0.5 S0.5 Sb0.5
• Title of publication: Extended phenothiazines: synthesis, photophysical and redox properties, and efficient photocatalytic oxidative coupling of amines
• Authors of publication: Zhou, Jun; Mao, Lijun; Wu, Meng-Xiang; Peng, Zhiyong; Yang, Yiming; Zhou, Manfei; Zhao, Xiao-Li; Shi, Xueliang; Yang, Hai-Bo
• Journal of publication: Chemical Science
• Year of publication: 2022
• a: 27.184 ± 0.005 Å
• b: 6.8384 ± 0.0013 Å
• c: 19.415 ± 0.004 Å
• α: 90°
• β: 133.036 ± 0.003°
• γ: 90°
• Cell volume: 2638 ± 0.9 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296.15 K
• Number of distinct elements: 6
• Space group number: 12
• Hermann-Mauguin space group symbol: C 1 2/m 1
• Hall space group symbol: -C 2y
• Residual factor for all reflections: 0.0864
• Residual factor for significantly intense reflections: 0.059
• Weighted residual factors for significantly intense reflections: 0.1625
• Weighted residual factors for all reflections included in the refinement: 0.1914
• Goodness-of-fit parameter for all reflections included in the refinement: 1.015
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No