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• W1981843706 abstract "In this paper we report a regioselective Bingel−Hirsch reaction of Sc3N@C78 yielding a single mono- and a dominate bis-ethyl malonate derivative for the first time. The Cs-symmetric monoadduct 1 and C2v-symmetric bisadduct 2 were isolated by HPLC and characterized by MS, UV−vis, and NMR spectroscopy. The symmetric bisadduct 2 clearly demonstrate the remarkable regioselectivity control exerted by the encapsulated Sc3N cluster. We have employed a LUMO electron density surface computational approach to predict multiadduct docking sites on the ellipsoidal fullerene cage surface." @default.
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• W1981843706 date "2008-01-25" @default.
• W1981843706 modified "2023-09-26" @default.
• W1981843706 title "Selective Formation of a Symmetric Sc₃N@C₇₈ Bisadduct: Adduct Docking Controlled by an Internal Trimetallic Nitride Cluster" @default.
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• W1981843706 doi "https://doi.org/10.1021/ja077630m" @default.
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