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Effect of Methoxy Ligand-Substituent and NCE Coligands in Tuning <i>T</i><sub>1/2</sub> of Coordinatively Elastic Fe(II) Spin Crossover Complexes

Sriram Sundaresan, Jonathan Kiehl, Luca M. Carrella, Eva Rentschler

2023Crystal Growth & Design11 citationsDOI

Abstract

We report the multistep synthesis of a thiadiazole based ligand ( L OMe-Nap ) with a methoxy substituent in the six-position of the naphthalene ring, along with the corresponding iron(II) [Fe II ( L OMe-Nap ) 2 (NCE) 2 ] 1 – 3 (E = S, Se, and BH 3 ) complexes. We also report the synthesis of the [Fe II ( L Nap ) 2 (NCBH 3 ) 2 ] ( 4 ) complex with the previously reported L Nap ligand. The complexes obtained were characterized by single crystal X-ray crystallography and SQUID magnetometry in all four cases ( 1 – 4 ). Complex 1 shows a weak thermally induced excited spin state trapping (TIESST) effect up to about 60 K. The effects of the methoxy ligand substituent in altering the noncovalent intramolecular π–π interaction are discussed, as well as the tuning of the switching temperature ( T 1/2 ) by the choice of NCE. The S < Se < BH 3 series is established in both families of compounds.

Topics & Concepts

SubstituentChemistryIntramolecular forceLigand (biochemistry)CrystallographyRing (chemistry)Spin crossoverExcited stateStereochemistryNaphthaleneSpin statesSingle crystalInorganic chemistryAtomic physicsPhysicsBiochemistryReceptorOrganic chemistryMagnetism in coordination complexesMetal-Catalyzed Oxygenation MechanismsLanthanide and Transition Metal Complexes
Effect of Methoxy Ligand-Substituent and NCE Coligands in Tuning <i>T</i><sub>1/2</sub> of Coordinatively Elastic Fe(II) Spin Crossover Complexes | Litcius