Experimental 17O NMR tensor parameters obtained for α-d-glucose from a spectral analysis of data presented in Fig. 1. The uncertainties in experimental values of δiso, δii (i = 1, 2, 3), CQ, and ηQ are estimated to be ±2 ppm, ±10 ppm, ±0.2 MHz, and ±0.2, respectively.
Atom | δ iso/ppm | δ 11/ppm | δ 22/ppm | δ 33/ppm | ∣CQ∣/MHz | η Q |
---|---|---|---|---|---|---|
O1 | 32 | 72 | 22 | 2 | 8.4 | 1.0 |
O2 | 2 | 27 | −6 | −12 | 9.1 | 1.0 |
O3 | 14 | 34 | 12 | −5 | 8.8 | 0.9 |
O4 | 13 | 33 | 6 | −2 | 8.9 | 1.0 |
O5 | 56 | 96 | 56 | 16 | 9.9 | 1.0 |
O6 | −5 | 20 | −5 | −30 | 9.0 | 0.9 |