Issue 19, 1973

The lone-pair orbital in NH3 and the calculation of the HNH angle

Abstract

A study has been made, using the Frost FSGO method, of the effect of modifying the form of the lonepair orbital of NH3 with a view to obtaining an improvement in the calculated value for the inter-bond angle, which is very low when the simple Frost method is used.

Article information

Article type
Paper

J. Chem. Soc., Chem. Commun., 1973, 736-737

The lone-pair orbital in NH3 and the calculation of the HNH angle

L. P. Tan and J. W. Linnett, J. Chem. Soc., Chem. Commun., 1973, 736 DOI: 10.1039/C39730000736

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