Author: Francesco Punzo

0000000001305201

AUTHOR

Francesco Punzo

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 coordination properties of the uranyl cation.

research product

CCDC 1519434: Experimental Crystal Structure Determination

Related Article: Arto Valkonen, Giuseppe M. Lombardo, Kari Rissanen, Francesco Punzo, Massimo Cametti|2017|Dalton Trans.|46|5240|doi:10.1039/C6DT04773D

research product

CCDC 1519435: Experimental Crystal Structure Determination

Related Article: Arto Valkonen, Giuseppe M. Lombardo, Kari Rissanen, Francesco Punzo, Massimo Cametti|2017|Dalton Trans.|46|5240|doi:10.1039/C6DT04773D

research product

CCDC 1519437: Experimental Crystal Structure Determination

Related Article: Arto Valkonen, Giuseppe M. Lombardo, Kari Rissanen, Francesco Punzo, Massimo Cametti|2017|Dalton Trans.|46|5240|doi:10.1039/C6DT04773D

research product

CCDC 1519433: Experimental Crystal Structure Determination

Related Article: Arto Valkonen, Giuseppe M. Lombardo, Kari Rissanen, Francesco Punzo, Massimo Cametti|2017|Dalton Trans.|46|5240|doi:10.1039/C6DT04773D

research product

CCDC 1519432: Experimental Crystal Structure Determination

Related Article: Arto Valkonen, Giuseppe M. Lombardo, Kari Rissanen, Francesco Punzo, Massimo Cametti|2017|Dalton Trans.|46|5240|doi:10.1039/C6DT04773D

research product

CCDC 1519436: Experimental Crystal Structure Determination

Related Article: Arto Valkonen, Giuseppe M. Lombardo, Kari Rissanen, Francesco Punzo, Massimo Cametti|2017|Dalton Trans.|46|5240|doi:10.1039/C6DT04773D

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PEPhysical Sciences and Engineering
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