Information card for entry 7131671

Structure parameters

• Formula: C66 H39 B F20 Pb
• Calculated formula: C66 H39 B F20 Pb
• SMILES: [Pb](c1c2C3(c4ccccc4c4c3cccc4)CC(C)(c2cc2C(C)(C)CC3(c4c(c5c3cccc5)cccc4)c12)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)c1c(F)c(F)c(F)c(F)c1F
• Title of publication: Aryldimethylelement cations of the heavier group 14 elements. An essentially three-coordinate plumbylium ion.
• Authors of publication: Janssen, Marvin; Mebs, Stefan; Beckmann, Jens
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2023
• Journal volume: 59
• Journal issue: 47
• Pages of publication: 7267 - 7270
• a: 10.2803 ± 0.001 Å
• b: 14.774 ± 0.002 Å
• c: 18.3384 ± 0.0019 Å
• α: 86.552 ± 0.007°
• β: 78.805 ± 0.004°
• γ: 85.707 ± 0.005°
• Cell volume: 2721.6 ± 0.5 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0333
• Residual factor for significantly intense reflections: 0.0256
• Weighted residual factors for significantly intense reflections: 0.0508
• Weighted residual factors for all reflections included in the refinement: 0.0526
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No