Table 1 Measured and calculated values of isotropic NMR chemical shifts (δ, ppm) in the[ Re12CS17(CN)6]n−complexes (n = 6, 8)
From: Electronic Switch in the Carbon-Centered [Re12CS17(CN)6]n−Nanocluster
Complexes | δ (exp) | δ (cal)a |
|---|---|---|
[Re1213CS17(CN)6]6− | 435 ± 1 | 388 |
[Re12CS17(13CN)6]6− | 127 ± 1 | 151.3 |
[Re1213CS17(CN)6]8− | 20 ± 1 | 66.8 |
[Re12CS17(13CN)6]8− | 126 ± 1 | 165.0 |