Bonding, Aromaticity and Isomerization of Furfuraldehyde through Off‐Nucleus Isotropic Magnetic Shielding
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DOI: 10.1002/open.202100202
Abstract: Abstract Off‐nucleus isotropic magnetic shielding (σ iso(r)) and multi‐points nucleus independent chemical shift (NICS(0‐2 Å)) index were utilized to find the impacts of the isomerization of gas‐phase furfuraldehyde (FD) on bonding and aromaticity of FD. Multidimensional… read more here.
Keywords: aromaticity; isotropic magnetic; isomerization; bonding aromaticity ... See more keywords