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Assembly of an R3N52− Chain by Cycloaddition of a Hydrazinediide and an Azide at Zirconium and its Thermal Fragmentation
Authors:Thorsten Gehrmann  Julio Lloret Fillol Dr  Hubert Wadepohl Prof Dr  Lutz H Gade Prof Dr
Institution:Anorganisch‐Chemisches Institut, Universit?t Heidelberg, Im Neuenheimer Feld 270, 69120 Heidelberg (Germany), Fax: (+49)?6221‐545609
Abstract:Breaking the chain : Reaction of a zirconium hydrazinediide with organoazides gives 2‐pentazene‐1,4‐diyl complexes, such as Zr(N2TBSNpy){N(Ad)N3NPh2}] (C gray, N blue, Si green, Zr turquoise), by formal 2+3] cycloaddition. Bonding within the N5 chain is investigated using density functional calculations. These complexes thermally eject N2 to give side‐on bonded diazenides.
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Keywords:azides  cycloaddition  density functional calculations  nitrogen  zirconium
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