Information card for entry 7219215

Structure parameters

• Formula: C3 H5 Cl Cu2 N4 S
• Calculated formula: C3 H5 Cl Cu2 N4 S
• Title of publication: Crystal engineering towards the luminescence property trimming of hybrid coordination polymers
• Authors of publication: Liu, Beibei; Bai, Liang; Lin, Xiaoling; Li, Kaixuan; Huang, Hui; Hu, Hailiang; Liu, Yang; Kang, Zhenhui
• Journal of publication: CrystEngComm
• Year of publication: 2015
• Journal volume: 17
• Journal issue: 7
• Pages of publication: 1686
• a: 11.1796 ± 0.0017 Å
• b: 8.4442 ± 0.0014 Å
• c: 17.314 ± 0.003 Å
• α: 90°
• β: 103.158 ± 0.002°
• γ: 90°
• Cell volume: 1591.6 ± 0.5 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: 0.0384
• Residual factor for significantly intense reflections: 0.0351
• Weighted residual factors for significantly intense reflections: 0.08
• Weighted residual factors for all reflections included in the refinement: 0.0813
• Goodness-of-fit parameter for all reflections included in the refinement: 1.175
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No