Information card for entry 7028513

Structure parameters

• Formula: C20 H18 N8 Pd S2
• Calculated formula: C20 H18 N8 Pd S2
• SMILES: [Pd]12(SC(=N[N]2=Cc2cccc3ccn1c23)N)[S]=C(N)NN=Cc1cccc2cc[nH]c12
• Title of publication: Indole-7-carbaldehyde thiosemicarbazone as a flexidentate ligand toward Zn(II), Cd(II), Pd(II) and Pt(II) ions: cytotoxic and apoptosis-inducing properties of the Pt(II) complex.
• Authors of publication: Ibrahim, Abeer A.; Khaledi, Hamid; Hassandarvish, Pouya; Mohd Ali, Hapipah; Karimian, Hamed
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 10
• Pages of publication: 3850 - 3860
• a: 12.2138 ± 0.0002 Å
• b: 11.6637 ± 0.0002 Å
• c: 18.0652 ± 0.0003 Å
• α: 90°
• β: 94.385 ± 0.003°
• γ: 90°
• Cell volume: 2566 ± 0.07 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 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: 0.0312
• Residual factor for significantly intense reflections: 0.0265
• Weighted residual factors for significantly intense reflections: 0.0704
• Weighted residual factors for all reflections included in the refinement: 0.0722
• Goodness-of-fit parameter for all reflections included in the refinement: 1.072
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No