Information card for entry 7709284

Structure parameters

• Chemical name: 3
• Formula: C20 H20 B Cl F4 N4 O2 Ru
• Calculated formula: C20 H20 B Cl F4 N4 O2 Ru
• Title of publication: Exploiting exo and endo furan-maleimide Diels–Alder linkages for the functionalization of organoruthenium complexes
• Authors of publication: Tran, Hoang-Van; Haghdoost, Mohammad Mehdi; Poulet, Sylvain; Tcherkawsky, Paul; Castonguay, Annie
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 9.0308 ± 0.0004 Å
• b: 9.5157 ± 0.0004 Å
• c: 14.3909 ± 0.0007 Å
• α: 82.575 ± 0.002°
• β: 78.701 ± 0.002°
• γ: 63.403 ± 0.001°
• Cell volume: 1083.16 ± 0.09 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0247
• Residual factor for significantly intense reflections: 0.0246
• Weighted residual factors for significantly intense reflections: 0.0643
• Weighted residual factors for all reflections included in the refinement: 0.0643
• Goodness-of-fit parameter for all reflections included in the refinement: 1.1
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.34139 Å
• Diffraction radiation type: GaKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No