Table 5. M–E distances [Å] of M-1–M-3 (from X-ray data and DFT calculations) and (Me3Si)3EM(donor) n [E = C, Si, Ge; M = Li, Na, K] (from the Cambridge Crystallographic DataBase).
Comp. | M···E (X-ray) | M···E (calc.) | Comp. | M–E (X-ray) a | Elongation b [%] |
Li-1 | 3.30 | 3.03 | (Me3Si)3CLi | 2.13 | 42 |
Na-1 | 3.23 | 3.18 | (Me3Si)3CNa | 2.48 | 28 |
K-1 | 3.32 | 3.34 | (Me3Si)3CK | 2.92 | 14 |
Li-2 | 3.92 | 3.74 | (Me3Si)3SiLi | 2.52 | 48 |
Na-2 | 4.00 | 3.94 | (Me3Si)3SiNa | 2.94 | 34 |
K-2 | 4.50 | 4.07 | (Me3Si)3SiK | 3.34 | 22 |
Li-3 | — | 3.88 | (Me3Si)3GeLi | 2.62 | 48 |
Na-3 | 4.05 | 4.01 | — c | — | — |
K-3 | 4.53 | 4.14 | (Me3Si)3GeK | 3.37 | 23 |
a Values are taken from the Cambridge Crystallographic Database and only those structures with the shortest M–E bonds were selected.
b Percent elongation of the E–M distance of M-1–M-3, derived from DFT from calculations, toward the E–M distance of (Me3Si)3EM, derived from the X-ray data.
c No X-ray data available.