Information card for entry 7214699

Structure parameters

• Formula: C12 H8 Cl2 Cu2 N2
• Calculated formula: C12 H8 Cl2 Cu2 N2
• Title of publication: New compounds based on polyoxometalates and metal halide clusters
• Authors of publication: Xiao, Li-Na; Hu, Yang-Yang; Wang, La-Mei; Wang, Yan; Xu, Jia-Ning; Ding, Hong; Cui, Xiao-Bing; Xu, Ji-Qing
• Journal of publication: CrystEngComm
• Year of publication: 2012
• Journal volume: 14
• Journal issue: 24
• Pages of publication: 8589
• a: 3.7358 ± 0.0007 Å
• b: 38.823 ± 0.008 Å
• c: 16.826 ± 0.004 Å
• α: 90°
• β: 95.27 ± 0.03°
• γ: 90°
• Cell volume: 2430 ± 0.9 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.1266
• Residual factor for significantly intense reflections: 0.0551
• Weighted residual factors for significantly intense reflections: 0.1113
• Weighted residual factors for all reflections included in the refinement: 0.1459
• Goodness-of-fit parameter for all reflections included in the refinement: 1.082
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No