Information card for entry 7011679

Structure parameters

• Common name: 1-Naphthylphenyliodonium Tetrakis(pentafluorophenyl)gallate
• Formula: C40 H12 F20 Ga I
• Calculated formula: C40 H12 F20 Ga I
• SMILES: [I+](c1ccccc1)c1cccc2ccccc12.[Ga](c1c(F)c(F)c(F)c(F)c1F)(c1c(F)c(F)c(F)c(F)c1F)(c1c(F)c(F)c(F)c(F)c1F)c1c(F)c(F)c(F)c(F)c1F
• Title of publication: The crystal and molecular structures of 1-naphthylphenyliodonium tetrafluoroborate and 1-naphthylphenyliodonium tetrakis(pentafluorophenyl)gallate
• Authors of publication: Kaafarani, Bilal R.; Gu, Haiyan; Alan Pinkerton, A.; Neckers, Douglas C.
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2002
• Journal issue: 11
• Pages of publication: 2318
• a: 15.003 ± 0.005 Å
• b: 18.287 ± 0.006 Å
• c: 14.738 ± 0.006 Å
• α: 90°
• β: 115.436 ± 0.013°
• γ: 90°
• Cell volume: 3652 ± 2 ų
• Cell temperature: 120 ± 1 K
• Ambient diffraction temperature: 120 ± 1 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: 0.025
• Residual factor for significantly intense reflections: 0.0237
• Weighted residual factors for significantly intense reflections: 0.0561
• Weighted residual factors for all reflections included in the refinement: 0.0568
• Goodness-of-fit parameter for all reflections included in the refinement: 1.101
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No