Information card for entry 7114951

Structure parameters

• Formula: C108 H97 B2 Cl4 Cu4 F8 P9
• Calculated formula: C108 H97 B2 Cl4 Cu4 F8 P9
• SMILES: [Cu]123[Cu]4([P](c5ccccc5)(c5ccccc5)C[P](c5ccccc5)(c5ccccc5)[Cu]56[Cu]([P]345c3ccccc3)([P](C[P]6(c3ccccc3)c3ccccc3)(c3ccccc3)c3ccccc3)[P](C[P]1(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)[P](C[P]2(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1.C(Cl)Cl.C(Cl)Cl.[B](F)(F)(F)[F-].[B](F)(F)(F)[F-]
• Title of publication: The first luminescent tetranuclear copper(i) μ4-phosphinidene complex
• Authors of publication: Wing-Wah Yam, Vivian; Chung-Chin Cheng, Eddie; Zhu, Nianyong
• Journal of publication: Chemical Communications
• Year of publication: 2001
• Journal issue: 11
• Pages of publication: 1028
• a: 14.456 ± 0.002 Å
• b: 28.797 ± 0.003 Å
• c: 25.34 ± 0.003 Å
• α: 90°
• β: 91.27 ± 0.02°
• γ: 90°
• Cell volume: 10546 ± 2 ų
• Cell temperature: 301 ± 2 K
• Ambient diffraction temperature: 301 ± 2 K
• Number of distinct elements: 7
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.0601
• Residual factor for significantly intense reflections: 0.0513
• Weighted residual factors for significantly intense reflections: 0.1381
• Weighted residual factors for all reflections included in the refinement: 0.1484
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No