Information card for entry 4106361

Structure parameters

• Formula: C36 H53 F3 N2 O3 S Sn
• Calculated formula: C36 H53 F3 N2 O3 S Sn
• SMILES: [Sn]1(OS(=O)(=O)C(F)(F)F)[N](=C(C(C)(C)C)C=C(N1c1c(cccc1C(C)C)C(C)C)C(C)(C)C)c1c(cccc1C(C)C)C(C)C
• Title of publication: A Neutral, Monomeric Germanium(I) Radical
• Authors of publication: William D. Woodul; Emma Carter; Robert Müller; Anne F. Richards; Andreas Stasch; Martin Kaupp; Damien M. Murphy; Matthias Driess; Cameron Jones
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2011
• Journal volume: 133
• Pages of publication: 10074 - 10077
• a: 12.668 ± 0.003 Å
• b: 18.474 ± 0.004 Å
• c: 18.756 ± 0.004 Å
• α: 118.73 ± 0.03°
• β: 92.63 ± 0.03°
• γ: 100.38 ± 0.03°
• Cell volume: 3741 ± 2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.0716
• Residual factor for significantly intense reflections: 0.0385
• Weighted residual factors for significantly intense reflections: 0.0657
• Weighted residual factors for all reflections included in the refinement: 0.0755
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No