Does Gd@C82 have an anomalous endohedral structure? ...



Title Does Gd@C82 have an anomalous endohedral structure? Synthesis and ingle Crystal x-ray structure of the carbene adduct
Author(s) Takeshi Akasaka, Takayoshi Kono, Yuji Takematsu, Hidefumi Nikawa, Tsukasa Nakahodo, Takatsugu Wakahara, Midori O. Ishitsuka, Takahiro Tsuchiya, Yutaka Maeda, Michael T. H. Liu, Kenji Yoza, Tatsuhisa Kato, Kazunori Yamamoto, Naomi Mizorogi, Zdenek Slanina, Shigeru Nagase
Journal Journal of the American Chemical Society
Date 2008
Volume 130
Issue 39
Start page 12840
End page 12841
Abstract Abstract: We report here the results on single crystal X-ray crystallographic analysis of the Gd@C82 carbene adduct (Gd@C82(Ad), Ad = adamantylidene). The Gd atom in Gd@C82(Ad) is located at an off-centered position near a hexagonal ring in the C2v-C82 cage, as found for M@C82 (M = Sc and La) and La@C82(Ad). Theoretical calculation also confirms the position of the Gd atom in the X-ray crystal structure.
DOI 10.1021/ja802156n

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