A systematic and comprehensive semiempirical, Hartree-Fock (HF) ab initio, and B3LYP density functional theory (DFT) study was conducted on the relative thermodynamic properties of various linear and ...
Decades of research on the autooxidation of organic compounds have provided fundamental and practical insights into these processes; however, the structure of many key autooxidation intermediates and ...
A leading synthetic challenge for chemists is how to precisely target a single C–H bond for reaction among many similar-looking ones in an organic molecule. Carefully crafted transition-metal ...
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