Information card for entry 7249164

Structure parameters

• Common name: RuCl-ImidazoleTriazenide
• Chemical name: [RuCl(1-MePh-3-imidazoletriazenide)(p-cymene)]
• Formula: C21 H26 Cl N5 Ru
• Calculated formula: C21 H26 Cl N5 Ru
• Title of publication: Ruthenium complexes with triazenide ligands bearing an N-heterocyclic moiety, and their catalytic properties in the reduction of nitroarenes
• Authors of publication: Romero-Soto, Christian A.; Iglesias, Ana L.; Velázquez-Ham, Amor F.; Camarena-Díaz, Juan P.; Correa-Ayala, Erick; Gomez-Lopez, Jessica L.; Chávez, Daniel; Ochoa-Terán, Adrián; Aguirre, Gerardo; Rheingold, Arnold L.; Grotjahn, Douglas B.; Parra-Hake, Miguel; Miranda-Soto, Valentín
• Journal of publication: RSC Advances
• Year of publication: 2024
• Journal volume: 14
• Journal issue: 33
• Pages of publication: 24019 - 24030
• a: 12.9896 ± 0.0004 Å
• b: 13.2753 ± 0.0004 Å
• c: 14.0569 ± 0.0004 Å
• α: 90 ± 0.003°
• β: 116.179 ± 0.003°
• γ: 90 ± 0.003°
• Cell volume: 2175.33 ± 0.13 ų
• Cell temperature: 293.1 ± 1 K
• Ambient diffraction temperature: 293.1 ± 1 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: 0.0393
• Residual factor for significantly intense reflections: 0.029
• Weighted residual factors for significantly intense reflections: 0.0644
• Weighted residual factors for all reflections included in the refinement: 0.0691
• Goodness-of-fit parameter for all reflections included in the refinement: 1.066
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No