Information card for entry 1512691

Structure parameters

• Formula: C13 H18 N2 O5.5 Pt
• Calculated formula: C13 H15 N2 O5.5 Pt
• SMILES: O=C1O[Pt]2([NH2]CCc3[n]2cccc3)OC(=O)C21CCC2.O.O
• Title of publication: DNA binding studies of a series of cis-[Pt(Am)2X2] complexes (Am = inert amine, X = labile carboxylato ligand)
• Authors of publication: Esther Escribano; Merce Font-Bardia; Teresa Calvet; Julia Lorenzo; Patrick Gamez; Virtudes Moreno
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2012
• Journal volume: 393
• Pages of publication: 65 - 76
• a: 10.1 ± 0.004 Å
• b: 18.415 ± 0.005 Å
• c: 18.323 ± 0.005 Å
• α: 90°
• β: 90.03 ± 0.02°
• γ: 90°
• Cell volume: 3407.9 ± 1.9 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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: 0.0665
• Residual factor for significantly intense reflections: 0.0584
• Weighted residual factors for significantly intense reflections: 0.1709
• Weighted residual factors for all reflections included in the refinement: 0.1793
• Goodness-of-fit parameter for all reflections included in the refinement: 1.079
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No