Information card for entry 4063639

Structure parameters

• Formula: C52 H54 B F15 N2 O Sn
• Calculated formula: C52 H54 B F15 N2 O Sn
• SMILES: [Sn]1([O](CC)CC)N(C(=CC(=[N]1c1c(cccc1C(C)C)C(C)C)C)C)c1c(cccc1C(C)C)C(C)C.Fc1c(c(F)c(F)c(F)c1F)[B-](c1c(F)c(F)c(F)c(F)c1F)(c1c(F)c(F)c(F)c(F)c1F)C
• Title of publication: Low-Coordinate Tin and Lead Cations
• Authors of publication: Taylor, Morgan J.; Saunders, Amy J.; Coles, Martyn P.; Fulton, J. Robin
• Journal of publication: Organometallics
• Year of publication: 2011
• Journal volume: 30
• Journal issue: 6
• Pages of publication: 1334
• a: 14.4223 ± 0.0001 Å
• b: 18.4966 ± 0.0002 Å
• c: 19.356 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5163.47 ± 0.09 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0344
• Residual factor for significantly intense reflections: 0.0291
• Weighted residual factors for significantly intense reflections: 0.0619
• Weighted residual factors for all reflections included in the refinement: 0.0641
• Goodness-of-fit parameter for all reflections included in the refinement: 1.009
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No