Journal article

Proton magnetic shielding tensors in benzene-from the individual molecule to the crystal

Three chem. distinct calcd. proton shielding tensors of solid benzene - a consequence of interactions in the crystal - can be described as the superposition of the isolated mol. and the intermol. shielding contributions. In the ovaloid representations of the shielding tensors 1, 2, and 3 indicate the least, intermediate, and the most shielded principal axes, resp. [on SciFinder (R)]


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