Studies on the reaction and quantum chemistry of thiazolidine-2-thione and (R)-thiazolidine-2-thione-4-carboxylic ethyl ester with α-bromopropylchloride

Ye Zhi Li; Chun Xiao Guo; Yan Qing Tian; Xiao Gang Zhao; Hua Min Huang

Studies on the reaction and quantum chemistry of thiazolidine-2-thione and (R)-thiazolidine-2-thione-4-carboxylic ethyl ester with α-bromopropylchloride

Ye Zhi Li, Chun Xiao Guo, Yan Qing Tian, Xiao Gang Zhao, Hua Min Huang

Research output: Contribution to journal › Article › peer-review

Abstract

Thiazolidine-2-α-bromopropyonyl thiol ester 2a and optically active (R)-thiazolidine-4-ethoxy carbonyl-2-α-bromopropyonyl thiol ester 2b were perpared by the reaction of α-bromopropyonyl chloride with thiazolidine-2-thione and (R)-thiazolidine-2-thione-4-carboxylic ethyl ester. The electronic structures of products and reactants were studied by molecular orbital PM3 method. The reaction enthalpies of products and the transition state of reactant 1a were obtained.

Original language	English (US)
Pages (from-to)	x28-958
Journal	Kao Teng Hsueh Hsiao Hua Heush Hsueh Pao/ Chemical Journal of Chinese Universities
Volume	19
Issue number	6
State	Published - 1998
Externally published	Yes

Keywords

(r)-thiazolidine-2-thione-4-carboxylic ethyl ester
(r)-thiazolidine-4-ethoxycarbonyl-2-α-bromopropyonyl thiol ester
Electronic structure
Reaction enthalpies
Thiazolidine-2-α-bromopropyonyl thiol ester

ASJC Scopus subject areas

General Chemistry

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Studies on the reaction and quantum chemistry of thiazolidine-2-thione and (R)-thiazolidine-2-thione-4-carboxylic ethyl ester with α-bromopropylchloride. / Li, Ye Zhi; Guo, Chun Xiao; Tian, Yan Qing et al.
In: Kao Teng Hsueh Hsiao Hua Heush Hsueh Pao/ Chemical Journal of Chinese Universities, Vol. 19, No. 6, 1998, p. x28-958.

Research output: Contribution to journal › Article › peer-review

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title = "Studies on the reaction and quantum chemistry of thiazolidine-2-thione and (R)-thiazolidine-2-thione-4-carboxylic ethyl ester with α-bromopropylchloride",

abstract = "Thiazolidine-2-α-bromopropyonyl thiol ester 2a and optically active (R)-thiazolidine-4-ethoxy carbonyl-2-α-bromopropyonyl thiol ester 2b were perpared by the reaction of α-bromopropyonyl chloride with thiazolidine-2-thione and (R)-thiazolidine-2-thione-4-carboxylic ethyl ester. The electronic structures of products and reactants were studied by molecular orbital PM3 method. The reaction enthalpies of products and the transition state of reactant 1a were obtained.",

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author = "Li, {Ye Zhi} and Guo, {Chun Xiao} and Tian, {Yan Qing} and Zhao, {Xiao Gang} and Huang, {Hua Min}",

year = "1998",

language = "English (US)",

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T1 - Studies on the reaction and quantum chemistry of thiazolidine-2-thione and (R)-thiazolidine-2-thione-4-carboxylic ethyl ester with α-bromopropylchloride

AU - Li, Ye Zhi

AU - Guo, Chun Xiao

AU - Tian, Yan Qing

AU - Zhao, Xiao Gang

AU - Huang, Hua Min

PY - 1998

Y1 - 1998

N2 - Thiazolidine-2-α-bromopropyonyl thiol ester 2a and optically active (R)-thiazolidine-4-ethoxy carbonyl-2-α-bromopropyonyl thiol ester 2b were perpared by the reaction of α-bromopropyonyl chloride with thiazolidine-2-thione and (R)-thiazolidine-2-thione-4-carboxylic ethyl ester. The electronic structures of products and reactants were studied by molecular orbital PM3 method. The reaction enthalpies of products and the transition state of reactant 1a were obtained.

AB - Thiazolidine-2-α-bromopropyonyl thiol ester 2a and optically active (R)-thiazolidine-4-ethoxy carbonyl-2-α-bromopropyonyl thiol ester 2b were perpared by the reaction of α-bromopropyonyl chloride with thiazolidine-2-thione and (R)-thiazolidine-2-thione-4-carboxylic ethyl ester. The electronic structures of products and reactants were studied by molecular orbital PM3 method. The reaction enthalpies of products and the transition state of reactant 1a were obtained.

KW - (r)-thiazolidine-2-thione-4-carboxylic ethyl ester

KW - (r)-thiazolidine-4-ethoxycarbonyl-2-α-bromopropyonyl thiol ester

KW - Electronic structure

KW - Reaction enthalpies

KW - Thiazolidine-2-α-bromopropyonyl thiol ester

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JF - Kao Teng Hsueh Hsiao Hua Heush Hsueh Pao/ Chemical Journal of Chinese Universities

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Studies on the reaction and quantum chemistry of thiazolidine-2-thione and (R)-thiazolidine-2-thione-4-carboxylic ethyl ester with α-bromopropylchloride

Abstract

Keywords

ASJC Scopus subject areas

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