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• W2319757322 abstract "We present an experimental and computational study of the oligomerization in icosahedral closo-(car)boranes Li2[B12H12] (I) and Li[CB11H12] (II). The experiments were performed on a hybrid ESI-TQ-FT-ICR mass spectrometer equipped with a 7.0 T superconducting magnet. The computational study consisted of finding energy minimum structures for the molecules I, II and the derived anions [B12H12]2–, [CB11H12]−, [I2–Li]−, and [II2–Li]−, as well as an estimate for the dissociation energy in the processes [X2–Li]− → X + [X–Li]− with X = I, II. Comparison of experiments and computations shows an excellent agreement for the bond dissociation energy in the process [II2–Li]− → II + [II–Li]− with ΔE = 1.5 eV." @default.
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• W2319757322 date "2013-01-14" @default.
• W2319757322 modified "2023-10-17" @default.
• W2319757322 title "Anionic Oligomerization of Li₂[B₁₂H₁₂] and Li[CB₁₁H₁₂]: An Experimental and Computational Study" @default.
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• W2319757322 doi "https://doi.org/10.1021/jp3102354" @default.
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