Information card for entry 4082116

Structure parameters

• Formula: C37 H40 F3 N3 O3 Os S
• Calculated formula: C37 H40 F3 N3 O3 Os S
• Title of publication: Synthesis, Characterization, and Reactivity of the First Osmium β-Diketiminato Complexes and Application in Catalysis
• Authors of publication: Schreiber, Dominique F.; O’Connor, Crystal; Grave, Christian; Müller-Bunz, Helge; Scopelliti, Rosario; Dyson, Paul J.; Phillips, Andrew D.
• Journal of publication: Organometallics
• Year of publication: 2013
• Journal volume: 32
• Journal issue: 24
• Pages of publication: 7345
• a: 10.9959 ± 0.0006 Å
• b: 12.4489 ± 0.0007 Å
• c: 13.082 ± 0.0008 Å
• α: 84.903 ± 0.005°
• β: 88.577 ± 0.005°
• γ: 68.497 ± 0.005°
• Cell volume: 1659.47 ± 0.18 ų
• Cell temperature: 140 ± 2 K
• Ambient diffraction temperature: 140 ± 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: 0.031
• Residual factor for significantly intense reflections: 0.0268
• Weighted residual factors for significantly intense reflections: 0.0684
• Weighted residual factors for all reflections included in the refinement: 0.0699
• Goodness-of-fit parameter for all reflections included in the refinement: 1.051
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No