rPM6 Parameters for Manganese and Application to Transition State Search for Oxidation Reactions of Cyclohexene by Manganese(IV)-Oxo Species-Reference-Cited by-同舟云学术

rPM6 Parameters for Manganese and Application to Transition State Search for Oxidation Reactions of Cyclohexene by Manganese(IV)-Oxo Species

Published:2017-10-05 Issue:10 Volume:46 Page:1567-1569
ISSN:0366-7022
Container-title:Chemistry Letters
language:en
Short-container-title:Chem. Lett.

Author:

Saito Toru¹,Takano Yu¹

Affiliation:

1. Department of Biomedical Information Sciences, Graduate School of Information Sciences, Hiroshima City University, 3-4-1 Ozuka-Higashi, Asa-Minami-ku, Hiroshima 731-3194

Publisher

The Chemical Society of Japan

Subject

General Chemistry

Link

http://www.journal.csj.jp/doi/pdf/10.1246/cl.170687

Reference25 articles.

1. Biologically inspired oxidation catalysis

2. Direct Hydroxylation of Benzene to Phenol Using Hydrogen Peroxide Catalyzed by Nickel Complexes Supported by Pyridylalkylamine Ligands

3. A pentanuclear iron catalyst designed for water oxidation

4. Factors Controlling the Chemoselectivity in the Oxidation of Olefins by Nonheme Manganese(IV)-Oxo Complexes

5. A new mixing of Hartree–Fock and local density‐functional theories

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2. Quantitative Assessment of rPM6 for Fluorine- and Chlorine-Containing Metal Complexes: Comparison with Experimental, First-Principles, and Other Semiempirical Results;Molecules;2018-12-15

3. Transition State Search Using rPM6: Iron- and Manganese-Catalyzed Oxidation Reactions as a Test Case;Bulletin of the Chemical Society of Japan;2018-09-15