What is it about?
Uranium complexes have been synthesized and investigated by X-ray single crystal diffraction and MD calculations in Periodic Boundary Conditions
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Why is it important?
DFT calculations demonstrated that the molecular orbital configuration and energies suit the described properties of complexes 1 and 2 suggesting a potential enantioselective activity as already shown by molecules belonging to this class of compounds.
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This page is a summary of: An integrated X-ray and molecular dynamics study of uranyl-salen structures and properties, Dalton Transactions, January 2012, Royal Society of Chemistry,
DOI: 10.1039/c1dt11758k.
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