Related Products of 1317-39-1, Chemistry is the science of change. But why do chemical reactions take place? Why do chemicals react with each other? The answer is in thermodynamics and kinetics.In a document type is Article, and a compound is mentioned, 1317-39-1, Copper(I) oxide, introducing its new discovery.
Ab initio theoretical study of Cu2S, CuS, Cu2O and CuO lead to the determination of their geometrical parameters.These molecules were showed to be strongly polarized.CuS and Cu2S normal modes wavenumbers were also calculated.Theoretical study of Cu2S electronic spectrum showed that all allowed transitions lead to ultraviolet radiations.The determination of the first and the second Cu2X ionization potentials (verticals and adiabatics) as well as the calculation of Cu2X(+) and Cu2X(2+) geometries allowed us to state accurately the Cu2S and Cu2O molecular orbital diagrams.
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Reference：
Copper catalysis in organic synthesis – NCBI,
Special Issue “Fundamentals and Applications of Copper-Based Catalysts”