Tuning the magnetic moment of [Ru2(DPhF)3(O 2CMe)L]+ complexes (DPhF=N,N′-Diphenylformamidinate) : A theoretical explanation of the axial ligand influence

Chemistry - A European Journal

Volumn 16, Issue 21, 2010, Pages 6203-6211

  Barral, M C ^a   Casanova, David ^b   Herrero, Santiago ^a   Jiménez Aparicio, Reyes ^a   Torres, M Rosario ^a   Urbanos, Francisco A ^a  

^a UNIVERSIDAD COMPLUTENSE DE MADRID   (Spain)

^b UNIVERSITY OF BARCELONA   (Spain)

Author keywords

Density functional calculations; Formamidinate compounds; Magnetic properties; Metal metal interactions; Ruthenium

Indexed keywords

4-METHYLPYRIDINE; ANTIFERRO-MAGNETIC INTERACTIONS; ANTIFERROMAGNETIC COUPLING; AXIAL LIGAND; AXIAL POSITIONS; COMPLEX 1; DENSITY-FUNCTIONAL CALCULATIONS; DFT CALCULATION; ENERGY LEVEL; EXPERIMENTAL DATA; FORMAMIDINATE; FORMAMIDINATE COMPOUNDS; MAGNETIC BEHAVIOUR; METAL-METAL INTERACTIONS; MOLECULAR FIELD APPROXIMATION; QUARTET STATE; REFERENCE COMPOUNDS; RELATIVE ENERGIES; SPIN CONFIGURATIONS; THEORETICAL EXPLANATION; THEORETICAL STUDY; ZERO-FIELD SPLITTINGS;

ANTIFERROELECTRICITY; ANTIFERROMAGNETIC MATERIALS; ANTIFERROMAGNETISM; LIGANDS; MAGNETIC MOMENTS; MAGNETIC PROPERTIES; METALS; RUTHENIUM; SPIN DYNAMICS; SULFUR COMPOUNDS;

COMPLEXATION;

EID: 77952684805     PISSN: 09476539     EISSN: 15213765     Source Type: Journal    
DOI: 10.1002/chem.200903404     Document Type: Article

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