Information card for entry 7717537

Structure parameters

• Formula: C16 H20 N6 Pd S2
• Calculated formula: C16 H20 N6 Pd S2
• Title of publication: Synthesis, structural characterisation, and anticancer potential of mono and dinuclear Pd(II) complexes of N-(2-pyridyl)thiourea
• Authors of publication: Pandey, Shivendra Kumar; Kumar, Sandeep; Singh, Swati; Patel, Anand Kumar; Gond, M. K.; Acharya, Arbind; Bharty, Manoj Kumar
• Journal of publication: Dalton Transactions
• Year of publication: 2024
• a: 8.8167 ± 0.0001 Å
• b: 7.8205 ± 0.0001 Å
• c: 13.4444 ± 0.0001 Å
• α: 90°
• β: 96.092 ± 0.001°
• γ: 90°
• Cell volume: 921.77 ± 0.017 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0417
• Residual factor for significantly intense reflections: 0.0417
• Weighted residual factors for significantly intense reflections: 0.1061
• Weighted residual factors for all reflections included in the refinement: 0.1061
• Goodness-of-fit parameter for all reflections included in the refinement: 1.063
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No