Information card for entry 7044180

Structure parameters

• Chemical name: Complex6
• Formula: C37 H44 Au F6 N4 O2 Sb
• Calculated formula: C37 H44 Au F6 N4 O2 Sb
• SMILES: c12cncc3c4c([Au](c5c1ccc(c5)C(C)(C)C)(=C(Nc1c(cccc1C)C)NCC(=O)OCC)[n]23)cc(cc4)C(C)(C)C.F[Sb](F)(F)(F)([F-])F
• Title of publication: (C^Npz^C)AuIII complexes of acyclic carbene ligands: synthesis and anticancer properties
• Authors of publication: Williams, Morwen; Green, Adam I.; Fernandez-Cestau, Julio; Hughes, David L.; O'Connell, Maria Anne; Searcey, Mark; Bertrand, Benoît; Bochmann, Manfred
• Journal of publication: Dalton Trans.
• Year of publication: 2017
• a: 18.8919 ± 0.0003 Å
• b: 10.1545 ± 0.0001 Å
• c: 20.9719 ± 0.0004 Å
• α: 90°
• β: 113.013 ± 0.002°
• γ: 90°
• Cell volume: 3703.02 ± 0.11 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• 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: 0.0301
• Residual factor for significantly intense reflections: 0.0243
• Weighted residual factors for significantly intense reflections: 0.05
• Weighted residual factors for all reflections included in the refinement: 0.052
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No