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dc.contributor.advisor 조재흥 -
dc.contributor.author Lee, Yujeong -
dc.date.accessioned 2020-08-06T06:16:56Z -
dc.date.available 2020-08-06T06:16:56Z -
dc.date.issued 2020 -
dc.identifier.uri http://dgist.dcollection.net/common/orgView/200000321130 en_US
dc.identifier.uri http://hdl.handle.net/20.500.11750/12179 -
dc.description Manganese(IV)–hydroxo complex, C–H bond activation, Oxygen non-rebound mechanism -
dc.description.abstract A high-valent manganese–hydroxo complex has been synthesized and characterized using various physicochemical methods such as UV–vis, ESI-MS, IRPD, and DFT calculations. Generally, manganese-oxygen adducts can activate C–H bond through an oxygen non-rebound mechanism where the rate of hydrogen atom transfer (HAT) depends on the strength of C–H bond. Herein, in the formation process of manganese–hydroxo complex, [MnIV(CHDAP–O)(OH)]2+, the C–H bond activation of the 2,6 position in cyclohexyl groups unusally proceeds via an oxygen rebound mechanism, in which HAT is identified as a rate determining step. -
dc.description.statementofresponsibility N -
dc.description.tableofcontents Contents
Abstract i
List of contents iii
List of figures iv
List of tables vi

I. Introduction

II. Experimental section
2.1 Materials and Instrumentation 2
2.2 Synthesis 3
2.2.1 A deuterated CHDAP ligand 3
2.2.2 [MnII(CHDAP)(OTf)2] 5
2.2.3 [MnIV(CHDAP–O)(OH)]2+ 6
2.3 X-ray crystallography 6

III. Results and discussion

3.1 Preparation and Characterization of a Deuterated CHDAP Ligand 10
3.2 Synthesis and Characterization of a Manganese(II)-Starting Complex 12
3.3 Synthesis and Characterization of a Manganese(IV)–Hydroxo Complex 15
3.4 The Effect of the Deuterium Exchange in the 2,6 Position of Cyclohexyl Groups 20
3.5 Consideration 27

IV. Conclusion

List of figures
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dc.format.extent 42 -
dc.language eng -
dc.publisher DGIST -
dc.title The Oxygen Rebound Mechanism of C-H Bond Oxidation Reaction by Non-Heme Manganese-Oxygen Species -
dc.type Thesis -
dc.identifier.doi 10.22677/thesis.200000321130 -
dc.description.alternativeAbstract 본 논문은 망가니즈 하이드록소 종의 형성 과정에서 일어나는 탄소-수소 결합 활성 메커니즘에 관한 것이다. 망가니즈-활성산소 종이 탄소-수소 결합을 산화시키는 과정에서는 일반적으로 산소가 다시 결합하지 않는 메커니즘으로 진행되는 것으로 알려져 있고 또한 수소원자 전달 과정의 속도는 탄소-수소 결합의 세기에 의존하는 것으로 알려져 있다.
본 논문에서는 망가니즈 하이드록소 종에서 사이클로헥실 그룹의 오소 위치의 수소가 산화되는 메커니즘이 산소 재결합 경로로 진행되는 것을 알아보기 위한 연구를 수행하였고, 수소원자 전달 과정이 속도 결정 단계임을 확인하였다.
본 논문은 망가니즈-활성산소 종들의 탄소-수소 산화반응 메커니즘을 규명하는 연구에 도움을 줄 수 있다.
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dc.description.degree Master -
dc.contributor.department Department of Emerging Materials Science -
dc.contributor.coadvisor Lee, Sunggi -
dc.date.awarded 2020/08 -
dc.publisher.location Daegu -
dc.description.database dCollection -
dc.citation XT.MM이66T 202008 -
dc.date.accepted 7/23/20 -
dc.contributor.alternativeDepartment 신물질과학전공 -
dc.embargo.liftdate 8/31/25 -
dc.contributor.affiliatedAuthor Lee, Yujeong -
dc.contributor.affiliatedAuthor Cho, Jaeheung -
dc.contributor.affiliatedAuthor Lee, Sunggi -
dc.contributor.alternativeName 이유정 -
dc.contributor.alternativeName Cho, Jaeheung -
dc.contributor.alternativeName 이성기 -
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