Information card for entry 4101436

Structure parameters

• Formula: C6 H7 Na3 O15.5 Ru
• Calculated formula: C6 Na3 O15.5 Ru
• SMILES: C1(=O)O[Ru]23(OC(=O)C(=O)O2)(OC1=O)OC(=O)C(=O)O3.[Na+].O.[Na+].O.O.[Na+].O
• Title of publication: A mixed-valent ruthenium-oxo oxalato cluster Na7[Ru4(mu3-O)4(C2O4)6] with potent anti-HIV activities.
• Authors of publication: Wong, Ella Lai-Ming; Sun, Raymond Wai-Yin; Chung, Nancy P-Y; Lin, Chen-Lung Steve; Zhu, Nianyong; Che, Chi-Ming
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2006
• Journal volume: 128
• Journal issue: 15
• Pages of publication: 4938 - 4939
• a: 18.78 ± 0.004 Å
• b: 14.609 ± 0.003 Å
• c: 12.213 ± 0.002 Å
• α: 90°
• β: 114.08 ± 0.03°
• γ: 90°
• Cell volume: 3059.1 ± 1.1 ų
• Cell temperature: 253 ± 2 K
• Ambient diffraction temperature: 253 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0624
• Residual factor for significantly intense reflections: 0.0517
• Weighted residual factors for significantly intense reflections: 0.1531
• Weighted residual factors for all reflections included in the refinement: 0.1581
• Goodness-of-fit parameter for all reflections included in the refinement: 1.16
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No