Information card for entry 1576419

Structure parameters

• Formula: C29 H32 Cl N Ru
• Calculated formula: C29 H32 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: 8.2888 ± 0.0009 Å
• b: 12.657 ± 0.0013 Å
• c: 23.549 ± 0.003 Å
• α: 90°
• β: 98.116 ± 0.004°
• γ: 90°
• Cell volume: 2445.8 ± 0.5 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/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0587
• Residual factor for significantly intense reflections: 0.0535
• Weighted residual factors for significantly intense reflections: 0.1047
• Weighted residual factors for all reflections included in the refinement: 0.1069
• Goodness-of-fit parameter for all reflections included in the refinement: 1.193
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No