Information card for entry 7000254

Structure parameters

• Formula: C19 H15 Cl2 N O4 Pt S
• Calculated formula: C19 H15 Cl2 N O4 Pt S
• SMILES: [Pt]([S](=O)(C)C)(Cl)(Cl)[n]2ccc3cc4OCOc4c4c5ccccc5C(=O)c2c34
• Title of publication: Potential new inorganic antitumour agents from combining the anticancer traditional Chinese medicine (TCM) liriodenine with metal ions, and DNA binding studies
• Authors of publication: Chen, Zhen-Feng; Liu, Yan-Cheng; Liu, Li-Min; Wang, Heng-Shan; Qin, San-Hai; Wang, Bo-Long; Bian, He-Dong; Yang, Bin; Fun, Hoong-Kun; Liu, Hua-Gang; Liang, Hong; Orvig, Chris
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 2
• Pages of publication: 262 - 272
• a: 8.4271 ± 0.0002 Å
• b: 10.7087 ± 0.0003 Å
• c: 11.8244 ± 0.0005 Å
• α: 109.749 ± 0.002°
• β: 102.533 ± 0.002°
• γ: 100.946 ± 0.001°
• Cell volume: 939.29 ± 0.06 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0294
• Residual factor for significantly intense reflections: 0.0251
• Weighted residual factors for significantly intense reflections: 0.0583
• Weighted residual factors for all reflections included in the refinement: 0.0602
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No