Issue 7, 1977

The strongest hydrogen-bond? Ab initio-LCAO-MO-SCF calculations

Abstract

Ab initio-LCAO–MO–SCF calculations indicate that the hydrogen-bond between the fluoride anion and formic acid, HCO2H ⋯ F, is stronger than that in the bifluoride anion, F–H ⋯ F, previously believed to be the upper limit of H-bond strength.

Article information

Article type
Paper

J. Chem. Soc., Chem. Commun., 1977, 225-226

The strongest hydrogen-bond? Ab initio-LCAO-MO-SCF calculations

J. Emsley, O. P. A. Hoyte and R. E. Overill, J. Chem. Soc., Chem. Commun., 1977, 225 DOI: 10.1039/C39770000225

To request permission to reproduce material from this article, please go to the Copyright Clearance Center request page.

If you are an author contributing to an RSC publication, you do not need to request permission provided correct acknowledgement is given.

If you are the author of this article, you do not need to request permission to reproduce figures and diagrams provided correct acknowledgement is given. If you want to reproduce the whole article in a third-party publication (excluding your thesis/dissertation for which permission is not required) please go to the Copyright Clearance Center request page.

Read more about how to correctly acknowledge RSC content.

Spotlight

Advertisements