Information card for entry 7708193

Structure parameters

• Formula: C34 H46.5 Au2 Cl F3 N4.5 O3 P S
• Calculated formula: C33 H45 Au2 Cl F3 N4 O3 P S
• SMILES: [Au](Cl)[P](C(C)(C)C)(C(C)(C)C)N1C=CN(c2c(cc(cc2C)C)C)C1=[Au][n]1cn(cc1)c1c(cc(cc1C)C)C.C(F)(F)(F)S(=O)(=O)[O-]
• Title of publication: Dinuclear gold(I) complexes with N-phosphanyl, N-heterocyclic carbene ligands: synthetic strategies, luminescence properties and anticancer activity
• Authors of publication: Trevisan, Gianmarco; Vitali, Valentina; Tubaro, Cristina; Graiff, Claudia; Marchenko, Anatolyi; Koidan, Georgyi; Hurieva, Anastasiya; Kostyuk, Aleksandr; Mauceri, Matteo; Rizzolio, Flavio; Accorsi, Gianluca; Biffis, Andrea
• Journal of publication: Dalton Transactions
• Year of publication: 2021
• a: 11.823 ± 0.003 Å
• b: 14.089 ± 0.004 Å
• c: 14.374 ± 0.004 Å
• α: 109.804 ± 0.003°
• β: 103.208 ± 0.004°
• γ: 90.001 ± 0.004°
• Cell volume: 2185.3 ± 1 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 2 K
• Number of distinct elements: 9
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.116
• Residual factor for significantly intense reflections: 0.0753
• Weighted residual factors for significantly intense reflections: 0.2063
• Weighted residual factors for all reflections included in the refinement: 0.2565
• Goodness-of-fit parameter for all reflections included in the refinement: 0.893
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No