TY  - GEN 
AU  - García Algarra, Andrés
A4  - Ciencia de los Materiales e Ingeniería Metalúrgica y Química Inorgánica
PY  - 2015
UR  - http://hdl.handle.net/10498/20454
AB  - The hexacoordinate complexes that the macrobicyclic ligands {(NH3)2sar}2+ and {(NMe3)2sar}2+ (sar = 3,6,10,13,16,19-hexaazabicyclo[6.6.6]icosane) form with transition metals such as CoIII, CoII and CuII can adopt several isomeric structures. In this...
LA  - eng
PB  - Willey
KW  - Density functional calculations
KW  - Energy analysis
KW  - Macrocycles
KW  - Transition metals
KW  - Isomers
TI  - Computational Insights into the Isomerism of Hexacoordinate Metal–Sarcophagine Complexes: The Relationship between Structure and Stability
DO  - 10.1002/ejic.201402984
ER  -