Information card for entry 7236501

Structure parameters

• Chemical name: [tetrakis(p-cymene)tetrakis(mu-cytosinato-kN1:kO2,kN3)tetraruthenium(II)] triflate
• Formula: C60 H72 F12 N12 O16 Ru4 S4
• Calculated formula: C60 H72 F12 N12 O16 Ru4 S4
• Title of publication: Supramolecular architectures based on p-cymene/ruthenium complexes functionalized with nucleobases
• Authors of publication: Sce, Fabio; Beobide, Garikoitz; Castillo, Oscar; de Pedro, Imanol; Pérez-Yáñez, Sonia; Reyes, Efraim
• Journal of publication: CrystEngComm
• Year of publication: 2017
• Journal volume: 19
• Journal issue: 40
• Pages of publication: 6039
• a: 14.4901 ± 0.0003 Å
• b: 14.4901 ± 0.0003 Å
• c: 17.3192 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3636.39 ± 0.18 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 86
• Hermann-Mauguin space group symbol: P 42/n :2
• Hall space group symbol: -P 4bc
• Residual factor for all reflections: 0.0685
• Residual factor for significantly intense reflections: 0.0579
• Weighted residual factors for significantly intense reflections: 0.1379
• Weighted residual factors for all reflections included in the refinement: 0.146
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No