Molecular Structure and Properties of a Novel Acylhydrazone (C14H14O6N4)·HCON(CH3)2·2H2O

Chemical Research in Chinese Universities ›› 2012, Vol. 28 ›› Issue (3): 524-528.

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Molecular Structure and Properties of a Novel Acylhydrazone (C₁₄H₁₄O₆N₄)·HCON(CH₃)₂·2H₂O

CHEN Feng-ying^1,2, WU Wang-ting^1,3, LI Heng-xin¹, HE Shui-yang¹, WEN Zhen-yi¹, LI Jia-xing²

1. Shaanxi Key Laboratory of Physico-Inorganic Chemistry, College of Chemistry & Materials Science, Northwest University, Xi’an 710069, P. R. China;
2. Department of Chemistry & Chemical Engineering, Shangluo University, Shangluo 726000, P. R. China;
3. Capital Museum, Beijing 100045, P. R. China

Received:2011-07-06 Revised:2011-08-19 Online:2012-05-25 Published:2012-05-03
Contact: HE Shui-yang E-mail:xdchemistry411@126.com
Supported by:
Supported by the Shaanxi Provincial Project of the Technology and Plan, China(No.2007K02-11), the Project of Education Committee of Shaanxi Province, China(No.2011JG04) and the Shaanxi Provincial Science and Technology Project, China (No.08ZDKG-268).

Abstract

Abstract: [N-(Propionic acid)] terephthalal acyl dihydrazone(H₄L) was synthesized and characterized by element analysis, IR, ¹H NMR and MS. The theoretical studies on H₄L were carried out at HF/6-31+G(d) and B3LYP/ 6-31+G(d) levels. The main decomposition stage of it was studied with IR track. The kinetic parameters[the apparent activation energy(E_a) and pre-exponential constant(A) of the first and second stages of decomposition reaction] were obtained by Kissinger and Ozawa’s methods. Furthermore, the antimicrobial activity of H₄L against wheat rust was investigated by spore sprout method.

Key words: Crystal structure, Quantum chemistry, Antimicrobial activity

CHEN Feng-ying, WU Wang-ting, LI Heng-xin, HE Shui-yang, WEN Zhen-yi, LI Jia-xing. Molecular Structure and Properties of a Novel Acylhydrazone (C₁₄H₁₄O₆N₄)·HCON(CH₃)₂·2H₂O[J]. Chemical Research in Chinese Universities, 2012, 28(3): 524-528.

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Molecular Structure and Properties of a Novel Acylhydrazone (C₁₄H₁₄O₆N₄)·HCON(CH₃)₂·2H₂O

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