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- W2022366997 endingPage "5987" @default.
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- W2022366997 abstract "The X[bond]H bond length in X[bond]H...Y hydrogen bonded complexes is controlled by a balance of two main factors acting in opposite directions. X[bond]H bond lengthening due to n(Y)-->sigma(H[bond]X) hyperconjugative interaction is balanced by X[bond]H bond shortening due to increase in the s-character and polarization of the X[bond]H. When hyperconjugation dominates, X[bond]H bond elongation is reflected in a concomitant red shift of the corresponding IR stretching frequency. When the hyperconjugative interaction is weak and the X-hybrid orbital in the X[bond]H is able to undergo a sufficient change in hybridization and polarization, rehybridization dominates leading to a shortening of the X[bond]H and a blue shift in the X[bond]H stretching frequency." @default.
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- W2022366997 date "2003-04-19" @default.
- W2022366997 modified "2023-10-16" @default.
- W2022366997 title "Electronic Basis of Improper Hydrogen Bonding: A Subtle Balance of Hyperconjugation and Rehybridization" @default.
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- W2022366997 doi "https://doi.org/10.1021/ja034656e" @default.
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