Information card for entry 7719914

Structure parameters

• Formula: C162 H153 Cl7 Cu20 N7 O12 P12
• Calculated formula: C162 H153 Cl7 Cu20 N7 O12 P12
• Title of publication: High-nuclearity Cu hydride nanoclusters of Cu₂₂H₁₉ and Cu₂₀H₁₃ consolidated by an N-containing triphosphine ligand: synthesis, characterization and catalysis.
• Authors of publication: Ma, Meng-Xia; Zhou, Yi-Wu; Gui, Zi-Jian; Huang, Ting-Hong; Ni, Qing-Ling; Li, Shi-Ming; Gui, Liu-Cheng; Wang, Xiu-Jian
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2025
• a: 26.2543 ± 0.0003 Å
• b: 26.2543 ± 0.0003 Å
• c: 113.8699 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 67973.6 ± 1.3 ų
• Cell temperature: 99.98 ± 0.11 K
• Ambient diffraction temperature: 99.98 ± 0.11 K
• Number of distinct elements: 7
• Space group number: 167
• Hermann-Mauguin space group symbol: R -3 c :H
• Hall space group symbol: -R 3 2"c
• Residual factor for all reflections: 0.0766
• Residual factor for significantly intense reflections: 0.0686
• Weighted residual factors for significantly intense reflections: 0.2185
• Weighted residual factors for all reflections included in the refinement: 0.2259
• Goodness-of-fit parameter for all reflections included in the refinement: 1.069
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No