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Computation of Atmospheric Concentrations of Molecular Clusters from ab initio Thermochemistry
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Conformational preferences for 3-piperideines: an Ab initio and molecular mechanics study

A M Belostotskii1, M Shokhen, H E Gottlieb

  • 1Chemistry Department, Bar-Ilan University, Ramat-Gan, Israel. belostot@mail.biu.ac.il

Chemistry (Weinheim an Der Bergstrasse, Germany)
|January 5, 2002
PubMed
Summary

This study presents rules for predicting substituent orientation in tetrahydropyridines using computational methods. These rules aid in understanding conformational preferences and revising stereochemical assignments.

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