Calculated reaction profiles for hydrogenation of anthracene mediated by monohydride intermediate in the low-valent Cr-L1 system with (a) Cr(0) and (b) Cr(I) center

August 15, 2024

• Title:       

  Calculated reaction profiles for hydrogenation of anthracene mediated by monohydride intermediate in the low-valent Cr-L1 system with (a) Cr(0) and (b) Cr(I) center

• Image Source:

  Chromium- and Cobalt-Catalyzed, Regiocontrolled Hydrogenation of Polycyclic Aromatic Hydrocarbons A Combined Experimental and Theoretical Study

• Mark:

  Figure 5

• Associated context:

  Extensive calculations were carried out to search for reaction pathways of hydrogenation of the first C=C double bond on the terminal aromatic carbocycle of anthracene, and the corresponding results for the two chromium monohydride are shown in Figure 5.