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EnglishWe previously demonstrated that the δNMR chemical shift of central NMR active atoms (A), in simple halido [AXn] (A=C, Si, Ge, Sn, Pb, Pt; Xn = combination of n halides, n = 4 or 6) derivatives, could be directly related to X radii overall sum, σ(rL). Further correlation have also been observed for tetrahedral [AX4] (A=C, Si; X4 = combination of four halides) compounds where the X Pauling electronegativities sum, σ(χLPau), Σ (χPauL) exceeds a specific value (≈12.4). In this work, we focused on these latter systems considering the H vs. X substitution. The analysis of the literature reported δ(13C) and δ(29Si) NMR chemical shift for the mono hydrogenated derivatives and in particular for [CHF3] and [SiHF3], characterized by the lowest σ(rL) and the highest σ(χLPau), Σ (χ PauL), suggests a revised value for the H electronegativity ranking with respect to Pauling's.
| Titolo: | Is hydrogen electronegativity higher than Pauling's value? New clues from the 13C and 29Si NMR chemical shifts of [CHF3] and [SiHF3] molecules |
| Autori: | |
| Data di pubblicazione: | 2019 |
| Rivista: | |
| Abstract: | We previously demonstrated that the δNMR chemical shift of central NMR active atoms (A), in simple halido [AXn] (A=C, Si, Ge, Sn, Pb, Pt; Xn = combination of n halides, n = 4 or 6) derivatives, could be directly related to X radii overall sum, σ(rL). Further correlation have also been observed for tetrahedral [AX4] (A=C, Si; X4 = combination of four halides) compounds where the X Pauling electronegativities sum, σ(χLPau), Σ (χPauL) exceeds a specific value (≈12.4). In this work, we focused on these latter systems considering the H vs. X substitution. The analysis of the literature reported δ(13C) and δ(29Si) NMR chemical shift for the mono hydrogenated derivatives and in particular for [CHF3] and [SiHF3], characterized by the lowest σ(rL) and the highest σ(χLPau), Σ (χ PauL), suggests a revised value for the H electronegativity ranking with respect to Pauling's. |
| Handle: | http://hdl.handle.net/11587/436283 |
| Appare nelle tipologie: | Articolo pubblicato su Rivista |
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