Information card for entry 7236376

Structure parameters

• Formula: C38 H32 Cu2 N8 O18 S4
• Calculated formula: C38 H28 Cu2 N8 O18 S4
• Title of publication: Changes of coordination modes of Cu-based coordination complexes as tuneable proton-conducting solid electrolytes
• Authors of publication: Wei, Mei-Jie; Fu, Jia-Qi; Wang, Yi-Di; Gu, Jing-Yang; Liu, Bai-Ling; Zang, Hong-Ying; Zhou, En-Long; Shao, Kui-Zhan; Su, Zhong-Min
• Journal of publication: Journal of Materials Chemistry A
• Year of publication: 2017
• Journal volume: 5
• Journal issue: 3
• Pages of publication: 1085
• a: 8.018 ± 0.005 Å
• b: 14.816 ± 0.005 Å
• c: 17.908 ± 0.005 Å
• α: 90 ± 0.005°
• β: 100.175 ± 0.005°
• γ: 90 ± 0.005°
• Cell volume: 2093.9 ± 1.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0685
• Residual factor for significantly intense reflections: 0.0411
• Weighted residual factors for significantly intense reflections: 0.0908
• Weighted residual factors for all reflections included in the refinement: 0.1011
• Goodness-of-fit parameter for all reflections included in the refinement: 1.017
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No