Information card for entry 7129259

Structure parameters

• Formula: C28 H32 K O6
• Calculated formula: C28 H32 K O6
• Title of publication: Controlling the unpaired electron by electrostatic attraction in the solid state
• Authors of publication: Cui, Haiyan; Wang, Liting; Ruan, Huapeng; Liu, Min; Feng, Zhongtao; Wang, Jie; Zhao, Yue; Wang, Xinping
• Journal of publication: Chemical Communications
• Year of publication: 2021
• a: 11.7079 ± 0.0006 Å
• b: 11.8131 ± 0.0006 Å
• c: 12.0431 ± 0.001 Å
• α: 109.702 ± 0.004°
• β: 98.73 ± 0.003°
• γ: 119.522 ± 0.002°
• Cell volume: 1257.61 ± 0.16 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1373
• Residual factor for significantly intense reflections: 0.0967
• Weighted residual factors for significantly intense reflections: 0.2112
• Weighted residual factors for all reflections included in the refinement: 0.2297
• Goodness-of-fit parameter for all reflections included in the refinement: 1.165
• Diffraction radiation wavelength: 1.34139 Å
• Diffraction radiation type: GaKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No