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Isolation of a Ge(I) Diradicaloid and Dihydrogen Splitting

Mahendra K. Sharma, Falk Ebeler, Timo Glodde, Beate Neumann, Hans‐Georg Stammler, Rajendra S. Ghadwal

2020Journal of the American Chemical Society61 citationsDOI

Abstract

The cyclic Ge(I) compound [(ADCPh)Ge]2 (4) (ADCPh = {CN(Dipp)}2CPh, Dipp = 2,6-iPr2C6H3) containing a 6π-electron C4Ge2 framework has been isolated as a red crystalline solid. CASSCF calculations reveal a closed-shell singlet ground state for 4 with a considerable diradical character (y = 34%). Thus, the diradicaloid 4 readily splits dihydrogen at room temperature to yield the elusive bis-hydridogermylene [(ADCPh)GeH]2 (5).

Topics & Concepts

DiradicalChemistrySinglet stateYield (engineering)Open shellCrystallographyCharacter (mathematics)Computational chemistryAtomic physicsOrganic chemistryThermodynamicsExcited statePhysicsMathematicsGeometrySynthesis and characterization of novel inorganic/organometallic compoundsOrganoboron and organosilicon chemistryCoordination Chemistry and Organometallics
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