Information card for entry 1549202

Structure parameters

• Formula: C27 H19 Cl F3 N3 O4 Pt S
• Calculated formula: C27 H19 Cl F3 N3 O4 Pt S
• SMILES: [Pt]12(Cl)[n]3ccccc3c3cc(cc([n]13)c1[n]2cccc1)c1ccc(OC)c2ccccc12.S(=O)(=O)([O-])C(F)(F)F
• Title of publication: Spectroscopy, electrochemistry and antiproliferative properties of Au(iii), Pt(ii) and Cu(ii) complexes bearing modified 2,2':6',2''-terpyridine ligands.
• Authors of publication: Maroń, Anna; Czerwińska, Katarzyna; Machura, Barbara; Raposo, Luis; Roma-Rodrigues, Catarina; Fernandes, Alexandra R.; Małecki, Jan G; Szlapa-Kula, Agata; Kula, Slawomir; Krompiec, Stanisław
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 18
• Pages of publication: 6444 - 6463
• a: 11.8647 ± 0.0007 Å
• b: 14.5225 ± 0.0008 Å
• c: 15.1167 ± 0.0007 Å
• α: 90°
• β: 94.526 ± 0.005°
• γ: 90°
• Cell volume: 2596.6 ± 0.2 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 8
• 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: 0.1173
• Residual factor for significantly intense reflections: 0.0506
• Weighted residual factors for significantly intense reflections: 0.0717
• Weighted residual factors for all reflections included in the refinement: 0.0875
• Goodness-of-fit parameter for all reflections included in the refinement: 0.9
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No