Information card for entry 4325895

Structure parameters

• Chemical name: trans-tetrachlorido-bis(2H-indazole)osmium(IV)
• Formula: C14 H12 Cl4 N4 Os
• Calculated formula: C14 H12 Cl4 N4 Os
• SMILES: Cl[Os]([n]1c2c(c[nH]1)cccc2)([n]1c2c(c[nH]1)cccc2)(Cl)(Cl)Cl
• Title of publication: En Route to Osmium Analogues of KP1019: Synthesis, Structure, Spectroscopic Properties and Antiproliferative Activity of trans-[OsIVCl4(Hazole)2]
• Authors of publication: Gabriel E. Büchel; Iryna N. Stepanenko; Michaela Hejl; Michael A. Jakupec; Bernhard K. Keppler; Vladimir B. Arion
• Journal of publication: Inorganic Chemistry
• Year of publication: 2011
• Journal volume: 50
• Pages of publication: 7690 - 7697
• a: 9.925 ± 0.003 Å
• b: 12.022 ± 0.003 Å
• c: 6.9802 ± 0.0015 Å
• α: 90°
• β: 108.128 ± 0.011°
• γ: 90°
• Cell volume: 791.5 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0684
• Residual factor for significantly intense reflections: 0.0311
• Weighted residual factors for significantly intense reflections: 0.0623
• Weighted residual factors for all reflections included in the refinement: 0.0686
• Goodness-of-fit parameter for all reflections included in the refinement: 0.989
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No