Information card for entry 7721114

Structure parameters

• Formula: C28 H35 Cl2 N3 O2 Ru S
• Calculated formula: C28 H35 Cl2 N3 O2 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: 16.3491 ± 0.0002 Å
• b: 10.3461 ± 0.0001 Å
• c: 17.6846 ± 0.0002 Å
• α: 90°
• β: 102.531 ± 0.001°
• γ: 90°
• Cell volume: 2920.08 ± 0.06 ų
• Cell temperature: 99.99 ± 0.1 K
• Ambient diffraction temperature: 99.99 ± 0.1 K
• Number of distinct elements: 7
• 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: 0.0244
• Residual factor for significantly intense reflections: 0.0233
• Weighted residual factors for significantly intense reflections: 0.0597
• Weighted residual factors for all reflections included in the refinement: 0.0605
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No