Chemistry Reference
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nized. Among the complexes considered, the complex of trimethylamine with
F
2
is probably closest to the Mulliken “inner”-type complexes.
The other types of halogen bonds, C-X
···
BorC-X
···
H-C are all consid-
erably weaker. The interaction energies of the C-X
···
B contacts rarely exceed
5 kcal
H-C contacts are even weaker. Neverthe-
less, in most cases they show all the structural and vibrational spectroscopic
features also encountered in the case of hydrogen bonding. The intermole-
cular distances are all consistently shorter than those expected from the sum
of van der Waals radii. Even the case of blue-shifting halogen bonds, in anal-
ogy to the blue-shifting hydrogen bonds, may occur. In both cases, the blue
shift is a consequence of the intramolecular coupling in the monomer [68].
/
mol, and those of the C-X
···
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