Information card for entry 7706785

Structure parameters

• Formula: C33 H29 Au Br0.83 Cl3.17 P2
• Calculated formula: C33 H29 Au Br0.828 Cl3.172 P2
• Title of publication: Development of a novel highly anti-proliferative family of gold complexes: Au(i)-phosphonium-phosphines.
• Authors of publication: Rousselle, Benjamin; Bouyer, Florence; Bayardon, Jérôme; Laly, Myriam; Ghiringhelli, François; Rousselin, Yoann; Bodio, Ewen; Malacea-Kabbara, Raluca
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2021
• Journal volume: 50
• Journal issue: 14
• Pages of publication: 4880 - 4889
• a: 25.312 ± 0.002 Å
• b: 9.6184 ± 0.0007 Å
• c: 13.5131 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3289.9 ± 0.4 ų
• Cell temperature: 110 ± 0.1 K
• Ambient diffraction temperature: 110 ± 0.1 K
• Number of distinct elements: 6
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.1258
• Residual factor for significantly intense reflections: 0.0644
• Weighted residual factors for significantly intense reflections: 0.1227
• Weighted residual factors for all reflections included in the refinement: 0.1461
• Goodness-of-fit parameter for all reflections included in the refinement: 0.986
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα~1~
• Diffraction radiation X-ray symbol: K-L~3~
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No