Information card for entry 7721115

Structure parameters

• Formula: C33 H35 Cl2 N3 O Ru S
• Calculated formula: C33 H35 Cl2 N3 O Ru S
• Title of publication: Organoruthenium(II) complexes appended with racemic pyrazoline ligands: An integrated experimental and theoretical insights revealing their apoptotic efficacy
• Authors of publication: Manimuthu, Akilesh; Bhuvanesh, Nattamai; Nallasamy, Professor Dr. Dharmaraj
• Journal of publication: Dalton Transactions
• Year of publication: 2026
• a: 9.69341 ± 0.00004 Å
• b: 16.40926 ± 0.00006 Å
• c: 24.07466 ± 0.00009 Å
• α: 90°
• β: 98.9839 ± 0.0004°
• γ: 90°
• Cell volume: 3782.38 ± 0.03 ų
• Cell temperature: 99.9 ± 0.3 K
• Ambient diffraction temperature: 99.9 ± 0.3 K
• Number of distinct elements: 7
• 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: 0.0244
• Residual factor for significantly intense reflections: 0.0241
• Weighted residual factors for significantly intense reflections: 0.0648
• Weighted residual factors for all reflections included in the refinement: 0.065
• Goodness-of-fit parameter for all reflections included in the refinement: 1.12
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No