Information card for entry 4333499

Structure parameters

• Formula: C15 H15 Cl Cu N6 O8 Pt
• Calculated formula: C15 H15 Cl Cu N6 O8 Pt
• SMILES: [Pt]123([Cu](OC4C=CN(C)C(=O)[N]1=4)(OC1C=CN(C)C(=O)[N]2=1)([O]=C1C3=CN(C)C(=O)N1)[OH2])Cl.O
• Title of publication: Tetrakis- and Tris(1-Methyluracil) Complexes of PtII: Formation and Properties of a Carbon-Bonded Nucleobase Species as Well as of Heternonuclear Derivatives
• Authors of publication: Holland, Lars; Shen, Wei-Zheng; Micklitz, Wolfgang; Lippert, Bernhard
• Journal of publication: Inorganic Chemistry
• Year of publication: 2007
• Journal volume: 46
• Journal issue: 26
• Pages of publication: 11356 - 11365
• a: 7.874 ± 0.0016 Å
• b: 14.403 ± 0.003 Å
• c: 24.386 ± 0.005 Å
• α: 90°
• β: 90.67 ± 0.03°
• γ: 90°
• Cell volume: 2765.4 ± 1 ų
• Cell temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for significantly intense reflections: 0.0476
• Weighted residual factors for all reflections included in the refinement: 0.0889
• Goodness-of-fit parameter for all reflections included in the refinement: 0.801
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No