X-Ray crystallographic and computational study on uranyl–salophen complexes bearing nitro groups
نویسندگان
چکیده
منابع مشابه
X-Ray crystallographic and computational study on uranyl-salophen complexes bearing nitro groups.
In the solid state, salophen-UO2 complexes bearing one, two, or three NO2 groups lack the pronounced ligand curvature that represents a structural hallmark for this class of compounds. A detailed structural study based on single-crystal X-ray crystallography and computational methods, comprising molecular dynamics, gas-phase Hartree Fock, and DFT calculations, was carried out to investigate the...
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ژورنال
عنوان ژورنال: Dalton Trans.
سال: 2017
ISSN: 1477-9226,1477-9234
DOI: 10.1039/c6dt04773d