Information card for entry 7714748

Structure parameters

• Formula: C44.5 H45 Ag2 Au Cl F12 N13 O0.5 P2
• Calculated formula: C44.5 H45 Ag2 Au Cl F12 N13 O0.5 P2
• Title of publication: Unexpected structural preference with metallophilic Ag-Au contacts in silver(I)-N-heterocyclic carbene cluster; experimental and theoretical approach.
• Authors of publication: Sahu, Priyanka; Jana, Narayan Ch; Barik, Sahadev; Kisan, Hemanta K.; Changotra, Avtar; Isab, Anvarhusein A.; Dinda, Joydev
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 53
• Journal issue: 3
• Pages of publication: 1099 - 1104
• a: 14.2719 ± 0.0004 Å
• b: 24.7697 ± 0.0006 Å
• c: 14.7213 ± 0.0004 Å
• α: 90°
• β: 96.862 ± 0.003°
• γ: 90°
• Cell volume: 5166.9 ± 0.2 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 10 K
• Number of distinct elements: 9
• Space group number: 12
• Hermann-Mauguin space group symbol: I 1 2/m 1
• Hall space group symbol: -I 2y
• Residual factor for all reflections: 0.0529
• Residual factor for significantly intense reflections: 0.0427
• Weighted residual factors for significantly intense reflections: 0.0927
• Weighted residual factors for all reflections included in the refinement: 0.0959
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No