Information card for entry 7711598

Structure parameters

• Formula: C54 H68 Br2 Cu4 N6
• Calculated formula: C54 H68 Br2 Cu4 N6
• Title of publication: Halide-Bridged Tetranuclear Organocopper(I) Clusters Supported by the Indolyl-based NCN Pincer Ligands and Their Catalytic Activities towards Hydrophosphination of Alkenes
• Authors of publication: Yuan, Qingbing; Huang, Zeming; Wu, weikang; Hong, Dongjing; Zhu, Shan; Wei, Jieding; Zhou, Shuangliu; Wang, Shaowu
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 12.8172 ± 0.0007 Å
• b: 20.874 ± 0.0011 Å
• c: 23.2383 ± 0.0012 Å
• α: 90°
• β: 104.313 ± 0.001°
• γ: 90°
• Cell volume: 6024.3 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293.15 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1122
• Residual factor for significantly intense reflections: 0.0545
• Weighted residual factors for significantly intense reflections: 0.1192
• Weighted residual factors for all reflections included in the refinement: 0.1409
• Goodness-of-fit parameter for all reflections included in the refinement: 1.019
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No