Information card for entry 4087679

Structure parameters

• Formula: C60 H48 Ag4 F20
• Calculated formula: C60 H48 Ag4 F20
• SMILES: [Ag]123([Ag]4([Ag]5([Ag]1([c]15c(c(c(c(c1F)F)F)F)F)[c]13c(c(c(c(c1F)F)F)F)F)([c]14c(c(c(c(c1F)F)F)F)F)[cH]1cc(c(c(c1)C)C)C)[c]12c(c(c(c(c1F)F)F)F)F)[cH]1cc(c(c(c1)C)C)C.c1ccc(c(c1C)C)C.c1cc(c(c(c1)C)C)C
• Title of publication: Pentafluorophenyl Silver: Structure and Bonding of Arene Solvates
• Authors of publication: Ibad, Muhammad Farooq; Schulz, Axel; Villinger, Alexander
• Journal of publication: Organometallics
• Year of publication: 2015
• Journal volume: 34
• Journal issue: 15
• Pages of publication: 3893
• a: 11.596 ± 0.0002 Å
• b: 13.4778 ± 0.0002 Å
• c: 20.1656 ± 0.0003 Å
• α: 86.366 ± 0.001°
• β: 75.371 ± 0.001°
• γ: 67.505 ± 0.001°
• Cell volume: 2815.51 ± 0.08 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0996
• Residual factor for significantly intense reflections: 0.0418
• Weighted residual factors for significantly intense reflections: 0.0677
• Weighted residual factors for all reflections included in the refinement: 0.0828
• Goodness-of-fit parameter for all reflections included in the refinement: 1.004
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No