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Conformational analysis of polyfunctional amino compounds by molecular mechanics.: Part II. 1,2-Ethanediamine, 1,3-propanediamine and 1,4-diazacyclohexanes

✍ Scribed by Luis Carballeira; Ricardo A. Mosquera; Miguel A. Rios; Clara A. Tovar

Publisher
Elsevier Science
Year
1989
Tongue
English
Weight
827 KB
Volume
193
Category
Article
ISSN
0022-2860

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The conformations of simple alkyl substituted 1 ,Bdiphenylethanes and the diastereoisomers of 3-amino-1,2,3triphenyl-1-propyl chloride were studied by the MM2 force field with the addition of electrostatic corrections to the aromatic force field as proposed recently by Allinger and Lii (dipole-dipol