Information card for entry 4327984

Structure parameters

• Formula: C5.25 H9 Cl3 N0.75 Na0.75 O1.12 Ru0.75 S0.75
• Calculated formula: C5.25 H9 Cl3 N0.75 Na0.75 O1.125 Ru0.75 S0.75
• Title of publication: Pyridine Analogues of the Antimetastatic Ru(III) Complex NAMI-A Targeting Non-Covalent Interactions with Albumin
• Authors of publication: Michael I. Webb; Ryan A. Chard; Yaser M. Al-Jobory; Michael R. Jones; Edwin W. Y. Wong; Charles J. Walsby
• Journal of publication: Inorganic Chemistry
• Year of publication: 2012
• Journal volume: 51
• Pages of publication: 954 - 966
• a: 13.1432 ± 0.0012 Å
• b: 13.1432 ± 0.0012 Å
• c: 19.6099 ± 0.0018 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 2933.6 ± 0.5 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 8
• Space group number: 152
• Hermann-Mauguin space group symbol: P 31 2 1
• Hall space group symbol: P 31 2"
• Residual factor for all reflections: 0.0819
• Residual factor for significantly intense reflections: 0.0659
• Weighted residual factors for all reflections: 0.0807
• Weighted residual factors for significantly intense reflections: 0.0677
• Weighted residual factors for all reflections included in the refinement: 0.0663
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0358
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No