Development of selective oxidation catalysts with multi-core active center using a theoretical approach

Research Project

Project/Area Number	21750089
Research Category	Grant-in-Aid for Young Scientists (B)
Allocation Type	Single-year Grants
Research Field	Synthetic chemistry
Research Institution	Tohoku University (2010) University of Tsukuba (2009)
Principal Investigator	NAKAGAWA Yoshinao 東北大学, 大学院・工学研究科, 助教 (10436545)
Project Period (FY)	2009 – 2010
Project Status	Completed (Fiscal Year 2010)
Budget Amount *help	¥3,120,000 (Direct Cost: ¥2,400,000、Indirect Cost: ¥720,000) Fiscal Year 2010: ¥650,000 (Direct Cost: ¥500,000、Indirect Cost: ¥150,000) Fiscal Year 2009: ¥2,470,000 (Direct Cost: ¥1,900,000、Indirect Cost: ¥570,000)
Keywords	合成化学 / 計算化学 / ポリオキソメタレート / バナジウム / 銀 / 選択酸化 / アルカン水酸化 / 多価アルコール / 量子化学計算
Research Abstract	Catalyses of polyoxometalate catalysts with di-vanadium core were investigated. The catalyst with phosphorous as a central atom showed high performance for both epoxidation of alkenes and hydroxylation of alkanes. Catalysts for selective oxidation of aqueous poly-ols were also investigated. The combination of silver and noble metal showed high performance.

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