Information card for entry 4335097

Structure parameters

• Chemical name: Tetrabutylammonium cis-tetrachlorido-1H-imidazole-nitrosyl-osmate(III)
• Formula: C19 H40 Cl4 N4 O Os
• Calculated formula: C19 H40 Cl4 N4 O Os
• SMILES: [Os](Cl)(Cl)(Cl)(Cl)([n]1c[nH]cc1)N=O.[N+](CCCC)(CCCC)(CCCC)CCCC
• Title of publication: Striking Difference in Antiproliferative Activity of Ruthenium- and Osmium-Nitrosyl Complexes with Azole Heterocycles
• Authors of publication: Gabriel E. Büchel; Anatolie Gavriluta; Maria Nowak; Samuel M. Meier; Michael A. Jakupec; Olesea Cuzan; Constantin Turta; Jean-Bernard Tommasino; Erwann Jeanneau; Ghenadie Novitchi; Dominique Luneau; Vladimir B. Arion
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 6273 - 6285
• a: 10.37 ± 0.001 Å
• b: 19.654 ± 0.002 Å
• c: 14.216 ± 0.001 Å
• α: 90°
• β: 108.02 ± 0.01°
• γ: 90°
• Cell volume: 2755.3 ± 0.5 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 6
• 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: 0.0611
• Residual factor for significantly intense reflections: 0.0533
• Weighted residual factors for significantly intense reflections: 0.1419
• Weighted residual factors for all reflections included in the refinement: 0.1482
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No