Information card for entry 2004769

Structure parameters

• Chemical name: Iodo-tris(triphenylphosphine)silver(I)
• Formula: C54 H45 Ag I P3
• Calculated formula: C54 H45 Ag I P3
• SMILES: I[Ag]([P](c1ccccc1)(c1ccccc1)c1ccccc1)([P](c1ccccc1)(c1ccccc1)c1ccccc1)[P](c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: Iodotris(triphenylphosphine)silver(I), [Ag(PPh~3~)~3~I]
• Authors of publication: Hibbs, D. E.; Hursthouse, M. B.; Malik, K. M. A.; Beckett, M. A.; Jones, P. W.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1996
• Journal volume: 52
• Journal issue: 4
• Pages of publication: 884 - 887
• a: 18.847 ± 0.003 Å
• b: 13.715 ± 0.002 Å
• c: 17.543 ± 0.003 Å
• α: 90°
• β: 95.93 ± 0.04°
• γ: 90°
• Cell volume: 4510.4 ± 1.3 ų
• Cell temperature: 140 ± 2 K
• Ambient diffraction temperature: 140 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0558
• Residual factor for significantly intense reflections: 0.0489
• Weighted residual factors for all reflections: 0.1177
• Weighted residual factors for significantly intense reflections: 0.116
• Goodness-of-fit parameter for all reflections: 1.011
• Goodness-of-fit parameter for significantly intense reflections: 1.096
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No