Hydrogen bond and internal rotations barrier: DFT study on heavier group-14 analogues of formamide-Reference-Cited by-同舟云学术

Hydrogen bond and internal rotations barrier: DFT study on heavier group-14 analogues of formamide

Published:2013-04-10 Issue:5 Volume:26 Page:420-431
ISSN:0894-3230
Container-title:Journal of Physical Organic Chemistry
language:en
Short-container-title:J. Phys. Org. Chem.

Author:

Xi Hong-Wei¹,Bedoura Sultana¹,Lim Kok Hwa¹

Affiliation:

1. Division of Chemical and Biomolecular Engineering, School of Chemical and Biomedical Engineering; Nanyang Technological University; 62 Nanyang Drive Singapore 637459

Publisher

Wiley

Subject

Organic Chemistry,Physical and Theoretical Chemistry

Link

http://onlinelibrary.wiley.com/wol1/doi/10.1002/poc.3103/fullpdf

Reference70 articles.

1. Resonance interactions in acyclic systems. 3. Formamide internal rotation revisited. Charge and energy redistribution along the C-N bond rotational pathway

2. Comparison and Scaling of Hartree-Fock and Density Functional Harmonic Force Fields. 1. Formamide Monomer

3. Theoretical Analysis of Secondary Kinetic Isotope Effects in C-N Rotation of Amides

4. High-Level Electron Correlation Calculations on Formamide and the Resonance Model

5. Equilibrium vs Ground-State Planarity of the CONH Linkage

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