Information card for entry 7057823

Structure parameters

• Formula: C20 H23 Cl N6 O4 Pd S2
• Calculated formula: C20 H23 Cl N6 O4 Pd S2
• Title of publication: Synthesis, characterisation, crystal structures and biological studies of palladium(ii) complexes containing 5-(2-hydroxy-3-methoxy-phenyl)-2,4-dihydro[1,2,4]triazole-3-thione derivatives
• Authors of publication: Shanmugapriya, A.; Dallemer, F.; Prabhakaran, R.
• Journal of publication: New Journal of Chemistry
• Year of publication: 2018
• Journal volume: 42
• Journal issue: 23
• Pages of publication: 18850
• a: 9.0019 ± 0.0003 Å
• b: 10.3208 ± 0.0003 Å
• c: 25.8409 ± 0.0009 Å
• α: 90°
• β: 94.137 ± 0.003°
• γ: 90°
• Cell volume: 2394.54 ± 0.14 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 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: 0.072
• Residual factor for significantly intense reflections: 0.0403
• Weighted residual factors for significantly intense reflections: 0.0647
• Weighted residual factors for all reflections included in the refinement: 0.0729
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No