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Published in 2022 at "Inorganic chemistry"
DOI: 10.1021/acs.inorgchem.1c02707
Abstract: Using the density functional theory, [(N2)RuIIL5]n+ species are studied in silico. The properties of the Ru-N2 bond are derived, including σ-donation, π-back donation, Ru-N and N-N bond lengths and bond orders, net charges and NN…
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Keywords:
ligand electrochemical;
donation;
design;
donation back ... See more keywords