DFT calculations of NMR JC–H coupling constants: An additional tool to characterize the α-agostic interaction in high oxidation state M-alkylidene complexes (M = Re, Mo and Ta)
Keywords: تحویل; NMR spin–spin JC–H coupling constant; DFT; GIAO; IGLO; Transition metal complexes; Re; Mo; Ta; Alkylidene complexes; α-Agostic interactions