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Ab Initio Study on the Tautomerism of Thioformamide Between Its Thione and Thiol Forms
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作者 Zhao Chengda, Chen Xiaofeng and Chen Bin (Department of Chemistrty, Northeast Normal University, Changchun) 《Chemical Research in Chinese Universities》 SCIE CAS CSCD 1991年第3期201-203,共3页
Introduction Thioformamide plays an important role in the organic and biochemical processes. Up to now, there are some reports on the static state study of its thione and thiol form tautumors, but few papes on the mec... Introduction Thioformamide plays an important role in the organic and biochemical processes. Up to now, there are some reports on the static state study of its thione and thiol form tautumors, but few papes on the mechanism of tautomerism between these two tautomors. Since this tautomerism equilibrium may model the proton shift isomerization of thionucleic acid bases approximately, the theoretical study on the mechanism and dynamics of such a process has important significance. 展开更多
关键词 Ab initio IRC thioformamide TAUTOMERISM
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