Information card for entry 7228711

Structure parameters

• Formula: C4 H16 Co N2 O10 S
• Calculated formula: C4 H16 Co N2 O10 S
• Title of publication: Switchable dielectric phase transition originating from disorder-order transformation and distortion in {[(C4H4N2)Co(H2O)4]SO4•2H2O}n
• Authors of publication: Mu, Rong; Xu, Guan-Cheng; Zhang, Ying-Ying; Zhang, Li; Jia, Dianzeng
• Journal of publication: CrystEngComm
• Year of publication: 2017
• a: 10.0656 ± 0.0013 Å
• b: 10.2656 ± 0.0014 Å
• c: 12.628 ± 0.0017 Å
• α: 90°
• β: 104.151 ± 0.002°
• γ: 90°
• Cell volume: 1265.2 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0386
• Residual factor for significantly intense reflections: 0.0366
• Weighted residual factors for significantly intense reflections: 0.1061
• Weighted residual factors for all reflections included in the refinement: 0.1079
• Goodness-of-fit parameter for all reflections included in the refinement: 1.097
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No