An article Ruthenium-Catalyzed Secondary Amine Formation Studied by Density Functional Theory WOS:000606850700001 published article about FINDING SADDLE-POINTS; AUXILIARY BASIS-SETS; BORROWING HYDROGEN; N-ALKYLATION; NONCOVALENT INTERACTIONS; REACTION PATHS; ALCOHOLS; TETRAHYDROQUINOLINES; DEHYDROGENATION; COMPLEXES in [Huckmann, Lukas; Alvarez-Barcia, Sonia; Kaestner, Johannes] Univ Stuttgart, Inst Theoret Chem, Pfaffenwaldring 55, D-70569 Stuttgart, Germany; [Fuhrer, Marina; Plietker, Bernd] Univ Stuttgart, Inst Organ Chem, Pfaffenwaldring 55, D-70569 Stuttgart, Germany; [Fuhrer, Marina; Plietker, Bernd] Tech Univ Dresden, Fak Chem & Lebensmittelchem, D-01062 Dresden, Germany in 2021.0, Cited 45.0. The Name is Benzyl Alcohol. Through research, I have a further understanding and discovery of 100-51-6. Safety of Benzyl Alcohol
Amines are a ubiquitous class of compounds found in a variety of functional organic building blocks. Within the past years, hydrogen autotransfer catalysis has evolved as a new concept for the synthesis of amines. A through understanding of the mechanism of these reactions is necessary to design optimal catalysts. We investigate secondary amine formation catalyzed by a NNNN(P)Ru-complex and provide understanding on the three reaction steps involved. We find that the ligand has to open one coordination site in order to allow the formation of a metal hydride intermediate. In a second step, a condensation reaction, which could also happen uncatalyzed in solution, is significantly enhanced by the presence of the ruthenium complex. The back-transfer of the hydride to the substrate in a third step regenerates the catalyst.
About Benzyl Alcohol, If you have any questions, you can contact Huckmann, L; Alvarez-Barcia, S; Fuhrer, M; Plietker, B; Kastner, J or concate me.. Safety of Benzyl Alcohol
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,Preparation of Indole Containing Building Blocks for the Regiospecific Construction of Indole Appended Pyrazoles and Pyrroles