Information card for entry 1552330

Structure parameters

• Formula: C16 H15 Br Cl N2 O3 Pt S
• Calculated formula: C16 H15 Br Cl N2 O3 Pt S
• SMILES: [Pt]1([N](N=C(O1)c1ccccc1)=Cc1c(O)ccc(c1)Br)([S](=O)(C)C)Cl
• Title of publication: Novel Pt(II) complexes with modified aroyl-hydrazone Schiff-base ligands: synthesis, cytotoxicity and action mechanism
• Authors of publication: Deng, Jungang; Yu, Ping; zhang, zhenlei; zhang, juzheng; Zhewen, Sun; Cai, Meiling; Yuan, Haoliang; Liang, Hong; Yang, Feng
• Journal of publication: Metallomics
• Year of publication: 2019
• a: 5.6653 ± 0.0005 Å
• b: 19.55 ± 0.002 Å
• c: 16.9661 ± 0.0017 Å
• α: 90°
• β: 91.032 ± 0.009°
• γ: 90°
• Cell volume: 1878.8 ± 0.3 ų
• Cell temperature: 296.15 K
• Ambient diffraction temperature: 296.15 K
• Number of distinct elements: 8
• 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: 0.0711
• Residual factor for significantly intense reflections: 0.0537
• Weighted residual factors for significantly intense reflections: 0.1231
• Weighted residual factors for all reflections included in the refinement: 0.1355
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No