Information card for entry 1576421

Structure parameters

• Formula: C27 H34 Cl N Ru
• Calculated formula: C27 H34 Cl N Ru
• Title of publication: Controlling Alkyne Dimerization and Trimerization with Ruthenium(II) Arene Isocyanide Catalysts
• Authors of publication: Lapa, Hugo; Del Rosso, Mattia; Zacchini, Stefano; Giarola , Greta; Alegria, Elisabete; Trzeciak, Anna; Marchetti, Fabio; Martins, Luisa Margarida; Biancalana, Lorenzo
• Journal of publication: Catalysis Science & Technology
• Year of publication: 2026
• a: 7.5945 ± 0.0004 Å
• b: 12.2445 ± 0.0006 Å
• c: 25.2295 ± 0.0012 Å
• α: 90°
• β: 91.324 ± 0.002°
• γ: 90°
• Cell volume: 2345.5 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0485
• Residual factor for significantly intense reflections: 0.043
• Weighted residual factors for significantly intense reflections: 0.093
• Weighted residual factors for all reflections included in the refinement: 0.0955
• Goodness-of-fit parameter for all reflections included in the refinement: 1.113
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No