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Two-Way Effects between Hydrogen Bond and Intramolecular Resonance Effect: An Ab Initio Study on Complexes of Formamide and Its Derivatives with Water

✍ Scribed by Liu, Tao; Li, Hua; Huang, Ming-Bao; Duan, Yong; Wang, Zhi-Xiang

Book ID
119947286
Publisher
American Chemical Society
Year
2008
Tongue
English
Weight
694 KB
Volume
112
Category
Article
ISSN
1089-5639

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The effect of hydrogen bonding on struct
The effect of hydrogen bonding on structural parameters: VI. The angular dependence of the hydrogen bond strength-AN ab initio Study of the formamide-water and the formamide-methane complexes
✍ Tor Otterson; Svein SΓ¦bΓΈ; Hans-JΓΈrgen Talberg πŸ“‚ Article πŸ“… 1976 πŸ› Elsevier Science βš– 292 KB

The effect of changing the L C=O -. \* H on the energy of the linear hydrogen bond has been studied by ab initio calculations for one formamide-methane complex and two formamide-water complexes, which differ in the position of the second hydrogen (H2,) of the water molecule (i.e. the one not involve