Information card for entry 2010651

Structure parameters

• Formula: C14 H22 N6 O6 Pt
• Calculated formula: C14 H22 N6 O6 Pt
• SMILES: [Pt]1(OC2N(C(=O)N(C)C(=O)C=2)C)([NH2]CC[NH2]1)C1C(=O)N(C(=O)N(C)C1=O)C
• Title of publication: Linkage isomerism of organoplatinum(II) compounds coordinated by two 1,3-dimethylbarbiturate anions
• Authors of publication: Noguchi, Kishie; Tamura, Takashi; Yuge, Hidetaka; Miyamoto, Takeshi Ken
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2000
• Journal volume: 56
• Journal issue: 2
• Pages of publication: 171 - 173
• a: 9.505 ± 0.002 Å
• b: 11.2518 ± 0.0009 Å
• c: 9.464 ± 0.002 Å
• α: 103.1 ± 0.01°
• β: 110.52 ± 0.01°
• γ: 87.93 ± 0.01°
• Cell volume: 922.2 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0381
• Residual factor for significantly intense reflections: 0.0263
• Weighted residual factors for all reflections included in the refinement: 0.061
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No