Information card for entry 7711867

Structure parameters

• Formula: C147 H131 Cl8 N O P8 Ru2
• Calculated formula: C144 H125 Cl2 N O P8 Ru2
• Title of publication: Multifunctional switching properties of "wire-like" dinuclear ruthenium bis-alkynyl spiropyran complexes.
• Authors of publication: Jago, David; Langley, Amelia R.; Eaves, Samantha G.; Walkey, Mark C.; Pulbrook, Thea; Moggach, Stephen A.; Piggott, Matthew J.; Low, Paul J.; Koutsantonis, George A.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2022
• Journal volume: 52
• Journal issue: 1
• Pages of publication: 185 - 200
• a: 9.8197 ± 0.0003 Å
• b: 12.7046 ± 0.0004 Å
• c: 54.4568 ± 0.0017 Å
• α: 85.315 ± 0.003°
• β: 88.454 ± 0.003°
• γ: 73.248 ± 0.003°
• Cell volume: 6483.7 ± 0.4 ų
• Cell temperature: 100.01 ± 0.1 K
• Ambient diffraction temperature: 100.15 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1981
• Residual factor for significantly intense reflections: 0.1744
• Weighted residual factors for significantly intense reflections: 0.3748
• Weighted residual factors for all reflections included in the refinement: 0.3894
• Goodness-of-fit parameter for all reflections included in the refinement: 1.067
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No