Information card for entry 7003238

Structure parameters

• Formula: C44 H39 Cl2 F18 N8 Nd O8 Ru S2
• Calculated formula: C44 H39 Cl2 F18 N8 Nd O8 Ru S2
• Title of publication: Heteronuclear bipyrimidine-bridged Ru‒Ln and Os‒Ln dyads: low-energy 3MLCT states as energy-donors to Yb(iii) and Nd(iii)
• Authors of publication: Lazarides, Theodore; Adams, Harry; Sykes, Daniel; Faulkner, Stephen; Calogero, Giuseppe; Ward, Michael D.
• Journal of publication: Dalton Transactions
• Year of publication: 2008
• Journal issue: 5
• Pages of publication: 691 - 698
• a: 20.802 ± 0.011 Å
• b: 12.338 ± 0.007 Å
• c: 24.436 ± 0.013 Å
• α: 90°
• β: 107.04 ± 0.009°
• γ: 90°
• Cell volume: 5996 ± 6 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 9
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1051
• Residual factor for significantly intense reflections: 0.0596
• Weighted residual factors for significantly intense reflections: 0.1391
• Weighted residual factors for all reflections included in the refinement: 0.1624
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No