Information card for entry 4303627

Structure parameters

• Chemical name: sodium-pentachloridopyrazoleosmate(IV) dihydrate
• Formula: C3 H8 Cl5 N2 Na O2 Os
• Calculated formula: C3 H8 Cl5 N2 Na O2 Os
• SMILES: [Os](Cl)(Cl)(Cl)(Cl)(Cl)[n]1[nH]ccc1.[Na+].O.O
• Title of publication: [OsIVCl5(Hazole)]- Complexes: Synthesis, Structure, Spectroscopic Properties, and Antiproliferative Activity
• Authors of publication: Gabriel E. Büchel; Iryna N. Stepanenko; Michaela Hejl; Michael A. Jakupec; Vladimir B. Arion; Bernhard K. Keppler
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Pages of publication: 10737 - 10747
• a: 6.5037 ± 0.0003 Å
• b: 6.8557 ± 0.0003 Å
• c: 13.5359 ± 0.0006 Å
• α: 96.816 ± 0.003°
• β: 91.235 ± 0.002°
• γ: 94.297 ± 0.003°
• Cell volume: 597.3 ± 0.05 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: 0.021
• Residual factor for significantly intense reflections: 0.0203
• Weighted residual factors for significantly intense reflections: 0.0545
• Weighted residual factors for all reflections included in the refinement: 0.0547
• Goodness-of-fit parameter for all reflections included in the refinement: 1.099
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No