Information card for entry 7014189

Structure parameters

• Formula: C14 H15 Au Br3 P
• Calculated formula: C14 H15 Au Br3 P
• SMILES: [Au](Br)(Br)(Br)[P](C)(c1ccccc1)Cc1ccccc1
• Title of publication: Governing the oxidative addition of iodine to gold(I) complexes by ligand tuning.
• Authors of publication: Schneider, Daniel; Schier, Annette; Schmidbaur, Hubert
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2004
• Journal issue: 13
• Pages of publication: 1995 - 2005
• a: 9.573 ± 0.001 Å
• b: 14.264 ± 0.001 Å
• c: 12.973 ± 0.001 Å
• α: 90°
• β: 104.1 ± 0.01°
• γ: 90°
• Cell volume: 1718.1 ± 0.3 ų
• Cell temperature: 199 ± 2 K
• Ambient diffraction temperature: 199 ± 2 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: 0.0547
• Residual factor for significantly intense reflections: 0.0405
• Weighted residual factors for significantly intense reflections: 0.1133
• Weighted residual factors for all reflections included in the refinement: 0.1198
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No