Information card for entry 7234647

Structure parameters

• Formula: C18 H30 Cl6 Cu N4 O
• Calculated formula: C18 H30 Cl6 Cu N4 O
• Title of publication: Stoichiometry mechanosynthesis and interconversion of metal salts containing [CuCl3(H2O)]- and [Cu2Cl8]4-
• Authors of publication: Guo, Fang; Li, Hai Tao; Famulari, Antonino; Xin, Lianxin; Zhou, Hongjian; Zhang, Peng
• Journal of publication: CrystEngComm
• Year of publication: 2019
• a: 6.978 ± 0.0006 Å
• b: 14.762 ± 0.0013 Å
• c: 12.3395 ± 0.001 Å
• α: 90°
• β: 100.14 ± 0.003°
• γ: 90°
• Cell volume: 1251.23 ± 0.18 ų
• Cell temperature: 298 K
• Ambient diffraction temperature: 298 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0322
• Residual factor for significantly intense reflections: 0.0303
• Weighted residual factors for significantly intense reflections: 0.0734
• Weighted residual factors for all reflections included in the refinement: 0.0749
• Goodness-of-fit parameter for all reflections included in the refinement: 1.066
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No