Information card for entry 4349738

Structure parameters

• Formula: C15 H16 Cl I2 N4 O P Pt
• Calculated formula: C15 H16 Cl I2 N4 O P Pt
• SMILES: [Pt]1([P]23CN4CN(CN(C4)C3)C2)(Cl)[n]2c3c(c(I)cc(I)c3O1)ccc2
• Title of publication: A new class of platinum(ii) complexes with the phosphine ligand pta which show potent anticancer activity
• Authors of publication: Živković, M. D.; Kljun, J.; Ilic-Tomic, T.; Pavic, A.; Veselinović, A.; Manojlović, D. D.; Nikodinovic-Runic, J.; Turel, I.
• Journal of publication: Inorganic Chemistry Frontiers
• Year of publication: 2018
• Journal volume: 5
• Journal issue: 1
• Pages of publication: 39
• a: 5.8236 ± 0.0003 Å
• b: 9.9683 ± 0.0006 Å
• c: 17.4696 ± 0.0009 Å
• α: 86.328 ± 0.004°
• β: 88.63 ± 0.004°
• γ: 73.328 ± 0.005°
• Cell volume: 969.49 ± 0.1 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0422
• Residual factor for significantly intense reflections: 0.0327
• Weighted residual factors for significantly intense reflections: 0.0599
• Weighted residual factors for all reflections included in the refinement: 0.0652
• Goodness-of-fit parameter for all reflections included in the refinement: 1.011
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No