Information card for entry 7706784

Structure parameters

• Formula: C42 H37 Au Br2 Cl2 Fe P2
• Calculated formula: C42 H37 Au Br2 Cl2 Fe 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: 18.7538 ± 0.0015 Å
• b: 17.9377 ± 0.0014 Å
• c: 23.5541 ± 0.0017 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 7923.6 ± 1.1 ų
• Cell temperature: 100 ± 1 K
• Ambient diffraction temperature: 100 ± 1 K
• Number of distinct elements: 7
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0408
• Residual factor for significantly intense reflections: 0.0291
• Weighted residual factors for significantly intense reflections: 0.0576
• Weighted residual factors for all reflections included in the refinement: 0.0609
• Goodness-of-fit parameter for all reflections included in the refinement: 1.066
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No