Information card for entry 4327142

Structure parameters

• Chemical name: Dichlorido(dimethyl sulfoxide)(4-formylphenoxyacetyl-hapto^6^-benzylamide) ruthenium(II)
• Formula: C18 H22 Cl2 N O4.5 Ru S
• Calculated formula: C18 H21 Cl2 N O4.5 Ru S
• Title of publication: Conjugation of Organoruthenium(II) 3-(1H-Benzimidazol-2-yl)pyrazolo[3,4-b]pyridines and Indolo[3,2-d]benzazepines to Recombinant Human Serum Albumin: a Strategy To Enhance Cytotoxicity in Cancer Cells
• Authors of publication: Iryna N. Stepanenko; Angela Casini; Fabio Edafe; Maria S. Novak; Vladimir B. Arion; Paul J. Dyson; Michael A. Jakupec; Bernhard K. Keppler
• Journal of publication: Inorganic Chemistry
• Year of publication: 2011
• Journal volume: 50
• Pages of publication: 12669 - 12679
• a: 8.5676 ± 0.0004 Å
• b: 10.8811 ± 0.0004 Å
• c: 11.4797 ± 0.0005 Å
• α: 72.819 ± 0.002°
• β: 89.461 ± 0.003°
• γ: 77.03 ± 0.002°
• Cell volume: 994.49 ± 0.07 ų
• Cell temperature: 100 ± 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: 0.059
• Residual factor for significantly intense reflections: 0.0461
• Weighted residual factors for significantly intense reflections: 0.12
• Weighted residual factors for all reflections included in the refinement: 0.1264
• Goodness-of-fit parameter for all reflections included in the refinement: 1.094
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No