Title : ( Conformational Analysis and Intramolecular Hydrogen Bonding in 4-Butylmino-3-Penten-2-One )
Authors: علیرضا برنجی , Samira Soltani Ghoshkhaneh , Mohamad Vakili ,
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Abstract
According to our calculations, 2 stable conformers were obtained. They were the same and the difference between them is the location of butyl group above or below the surface of the molecule. The N…O distance is 2.664 Ǻ. It confirms that the hydrogen bond in this molecule is slightly stronger than that in 4-amino-3-penten-2-one (APO) [4].
Keywords
Conformational Analysis; Intramolecular Hydrogen Bonding; DFT
@inproceedings{paperid:1061796,
author = {علیرضا برنجی and Soltani Ghoshkhaneh, Samira and Vakili, Mohamad},
title = {Conformational Analysis and Intramolecular Hydrogen Bonding in 4-Butylmino-3-Penten-2-One},
booktitle = {نوزدهمین کنگره شیمی ایران},
year = {2017},
location = {شیراز, IRAN},
keywords = {Conformational Analysis; Intramolecular Hydrogen Bonding; DFT},
}
%0 Conference Proceedings
%T Conformational Analysis and Intramolecular Hydrogen Bonding in 4-Butylmino-3-Penten-2-One
%A علیرضا برنجی
%A Soltani Ghoshkhaneh, Samira
%A Vakili, Mohamad
%J نوزدهمین کنگره شیمی ایران
%D 2017
