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. 2022 Jan 21;27(3):708. doi: 10.3390/molecules27030708

Figure 4.

Figure 4

Schematic representation of the HiPIP-like η3-allyl (π/σ) complex. The hyperfine coupling constants Aiso obtained after HYSCORE measurements of 13C-labelled HMBPP as well as the iron-carbon distances dFe-C estimated by DFT calculations are given for the C2, C3, and C4 atom [68].