Information card for entry 7064292

Structure parameters

• Formula: C42 H28 K2.74 Li0.26 Ni6 O15 S8
• Calculated formula: C42 H27.999 K2.735 Li0.265 Ni6 O14.9994 S8
• Title of publication: The energy-storage mechanism of a battery-type coordination polymer electrode material for hybrid supercapacitors
• Authors of publication: Liu, Yuanyuan; Lin, Xihao; Li, Xinhua; Zhang, Weibing; Yang, Zhi; Xu, Xiangju
• Journal of publication: New Journal of Chemistry
• Year of publication: 2026
• Journal volume: 50
• Journal issue: 10
• Pages of publication: 4322 - 4332
• a: 13.2971 ± 0.0009 Å
• b: 13.2971 ± 0.0009 Å
• c: 18.6295 ± 0.0017 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 2852.6 ± 0.4 ų
• Cell temperature: 193 K
• Ambient diffraction temperature: 193 K
• Number of distinct elements: 7
• Space group number: 176
• Hermann-Mauguin space group symbol: P 63/m
• Hall space group symbol: -P 6c
• Residual factor for all reflections: 0.0805
• Residual factor for significantly intense reflections: 0.0506
• Weighted residual factors for significantly intense reflections: 0.1067
• Weighted residual factors for all reflections included in the refinement: 0.1214
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No