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Quantum chemical studies on hypothetical Fischer type Mo(CO)(5)[C(OEt)Me] and Mo(CO)(5)[C(OMe)Et] carbene complexes
(ELSEVIER SCIENCE BV, 2018)
Quantum chemical calculations at B3LYP/LANL2DZ/6-31G(d) level were made on anti-eclipsed, anti-staggered, syn-eclipsed, syn-staggered conformers of hypothetical Fischer type Mo(CO)(5)[C(OEt)Me] and Mo(CO)(5)[C(OMe)Et] ...