Information card for entry 4342773

Structure parameters

• Formula: C50 H16 F20 N2 Pb Pt2
• Calculated formula: C50 H16 F20 N2 Pb Pt2
• SMILES: [n]12[Pt](c3c(c(c(c(c3F)F)F)F)F)(c3c(c(c(F)c(F)c3F)F)F)([Pb][Pt]3([n]4cccc5ccc6cccc3c6c45)(c3c(c(c(c(c3F)F)F)F)F)c3c(c(F)c(F)c(F)c3F)F)c3cccc4ccc(ccc1)c2c34
• Title of publication: An Extended Chain and Trinuclear Complexes Based on Pt(II)-M (M = Tl(I), Pb(II)) Bonds: Contrasting Photophysical Behavior.
• Authors of publication: Forniés, Juan; Giménez, Nora; Ibáñez, Susana; Lalinde, Elena; Martín, Antonio; Moreno, M. Teresa
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 9
• Pages of publication: 4351 - 4363
• a: 31.026 ± 0.0003 Å
• b: 31.026 ± 0.0003 Å
• c: 20.8832 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 20102.4 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 142
• Hermann-Mauguin space group symbol: I 41/a c d :2
• Hall space group symbol: -I 4bd 2c
• Residual factor for all reflections: 0.0603
• Residual factor for significantly intense reflections: 0.031
• Weighted residual factors for significantly intense reflections: 0.0581
• Weighted residual factors for all reflections included in the refinement: 0.0625
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No