Information card for entry 1557235

Structure parameters

• Formula: C34 H50 Au Cl2 F6 N O P Sb
• Calculated formula: C34 H50 Au Cl2 F6 N O P Sb
• SMILES: c12ccccc1[N](C)(C)[Au]1([CH]3=[CH]1OCCC3)[P]2(C12CC3CC(C1)CC(C2)C3)C12CC3CC(CC(C1)C3)C2.C(Cl)Cl.[Sb](F)(F)(F)([F-])(F)F
• Title of publication: Versatility and adaptative behaviour of the P^N chelating ligand MeDalphos within gold(i) π complexes
• Authors of publication: Navarro, Miquel; Toledo, Alberto; Mallet-Ladeira, Sonia; Sosa Carrizo, E. Daiann; Miqueu, Karinne; Bourissou, Didier
• Journal of publication: Chemical Science
• Year of publication: 2020
• Journal volume: 11
• Journal issue: 10
• Pages of publication: 2750 - 2758
• a: 10.9121 ± 0.0011 Å
• b: 17.7644 ± 0.0018 Å
• c: 19.509 ± 0.002 Å
• α: 90°
• β: 104.904 ± 0.003°
• γ: 90°
• Cell volume: 3654.5 ± 0.6 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 9
• 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: 0.0392
• Residual factor for significantly intense reflections: 0.0302
• Weighted residual factors for significantly intense reflections: 0.0736
• Weighted residual factors for all reflections included in the refinement: 0.079
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No