Information card for entry 4348295

Structure parameters

• Common name: P2
• Formula: C46 H50 Cl4 N18 O3 Pt2 S7
• Calculated formula: C46 H50 Cl4 N18 O3 Pt2 S7
• SMILES: c1(ccc(cc1)Cl)NC1=N[N]2=C(c3n4nc(C(=NN=C(Nc5ccc(cc5)Cl)S[Pt]56SC(=N[N]5=C(c5n6nc(C(=NN=C(Nc6ccc(cc6)Cl)S[Pt]24S1)C)n5)C)Nc1ccc(cc1)Cl)C)n3)C.CS(C)=O.CS(C)=O.CS(C)=O
• Title of publication: A structural and biological study on the new 3,5-diacetyl-1,2,4-triazol bis(p-chlorophenylthiosemicarbazone) ligand and its bimetallic complexes
• Authors of publication: Matesanz, A. I.; Albacete, P.; Perles, J.; Souza, P.
• Journal of publication: Inorganic Chemistry Frontiers
• Year of publication: 2015
• Journal volume: 2
• Journal issue: 1
• Pages of publication: 75
• a: 14.6278 ± 0.0002 Å
• b: 15.606 ± 0.0002 Å
• c: 15.6896 ± 0.0003 Å
• α: 66.436 ± 0.001°
• β: 81.756 ± 0.001°
• γ: 68.305 ± 0.001°
• Cell volume: 3050.39 ± 0.09 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0812
• Residual factor for significantly intense reflections: 0.0434
• Weighted residual factors for significantly intense reflections: 0.1126
• Weighted residual factors for all reflections included in the refinement: 0.1454
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No