Hydrogen bonding without borders: an atoms-in-molecules perspective

Parthasarathi, R. ; Subramanian, V. ; Sathyamurthy, N. (2006) Hydrogen bonding without borders: an atoms-in-molecules perspective Journal of Physical Chemistry A, 110 (10). pp. 3349-3351. ISSN 1089-5639

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Official URL: http://pubs.acs.org/doi/abs/10.1021/jp060571z

Related URL: http://dx.doi.org/10.1021/jp060571z

Abstract

It is shown that the electron density at the hydrogen bond critical point increases approximately linearly with increasing stabilization energy in going from weak hydrogen bonds to moderate and strong hydrogen bonds, thus serving as an indicator of the nature and gradual change of strength of the hydrogen bond for a large number of test intermolecular complexes.

Item Type:Article
Source:Copyright of this article belongs to American Chemical Society.
ID Code:43871
Deposited On:17 Jun 2011 06:04
Last Modified:17 Jun 2011 06:04

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