Information card for entry 4305719

Structure parameters

• Chemical name: trans-[Dichloridotetrakis(imidazole)ruthenium(III)]chloride
• Formula: C12 H16 Cl3 N8 Os
• Calculated formula: C12 H16 Cl3 N8 Os
• SMILES: c1c[nH]c[n]1[Os]([n]1cc[nH]c1)(Cl)(Cl)([n]1cc[nH]c1)[n]1cc[nH]c1.[Cl-]
• Title of publication: Synthesis, Structure, Spectroscopic Properties, and Antiproliferative Activity In Vitro of Novel Osmium(III) Complexes with Azole Heterocycles
• Authors of publication: Iryna Stepanenko; Artem A. Krokhin; Roland O. John; Alexander Roller; Vladimir B. Arion; Michael A. Jakupec; Bernhard K. Keppler
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 7338 - 7347
• a: 9.611 ± 0.0003 Å
• b: 18.9329 ± 0.0009 Å
• c: 9.6818 ± 0.0003 Å
• α: 90°
• β: 90.016 ± 0.002°
• γ: 90°
• Cell volume: 1761.74 ± 0.11 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0119
• Residual factor for significantly intense reflections: 0.0115
• Weighted residual factors for significantly intense reflections: 0.0306
• Weighted residual factors for all reflections included in the refinement: 0.0308
• Goodness-of-fit parameter for all reflections included in the refinement: 1.088
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No