Information card for entry 2220879

Structure parameters

• Chemical name: (3,5,7-Tribromotropolonato-κ^2^<i>O</i>,<i>O</i>')tris(triphenylphosphine- κ<i>P</i>)silver(I)
• Formula: C61 H47 Ag Br3 O2 P3
• Calculated formula: C61 H47 Ag Br3 O2 P3
• SMILES: [Ag]1([P](c2ccccc2)(c2ccccc2)c2ccccc2)([P](c2ccccc2)(c2ccccc2)c2ccccc2)([P](c2ccccc2)(c2ccccc2)c2ccccc2)[O]=C2C(O1)=C(Br)C=C(Br)C=C2Br
• Title of publication: (3,5,7-Tribromotropolonato-κ^2^<i>O</i>,<i>O</i>')tris(triphenylphosphine-κ<i>P</i>)silver(I)
• Authors of publication: Steyl, G.; Hill, T. N.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 2
• Pages of publication: m191
• a: 13.257 ± 0.001 Å
• b: 27.155 ± 0.0017 Å
• c: 14.688 ± 0.001 Å
• α: 90°
• β: 93.121 ± 0.002°
• γ: 90°
• Cell volume: 5279.7 ± 0.6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• 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: 0.0879
• Residual factor for significantly intense reflections: 0.0456
• Weighted residual factors for significantly intense reflections: 0.1153
• Weighted residual factors for all reflections included in the refinement: 0.1647
• Goodness-of-fit parameter for all reflections included in the refinement: 1.073
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes