Crystallographic characterization and structural analysis of the first organic functionalization product of the endohedral fullerene Sc3N@C80

Hon Man Lee; Marilyn M. Olmstead; Erick Iezzi; James C. Duchamp; Harry C. Dorn; Alan L. Balch

doi:10.1021/ja020065x

Crystallographic characterization and structural analysis of the first organic functionalization product of the endohedral fullerene Sc₃N@C₈₀

Hon Man Lee, Marilyn M. Olmstead, Erick Iezzi, James C. Duchamp, Harry C. Dorn, Alan L. Balch

Department of Chemistry

Research output: Contribution to journal › Article › peer-review

131 Citations (Scopus)

Abstract

The structure of Sc₃N@C₈₀-C₁₀H₁₂O₂, a Diels-Alder cycloadduct of Sc₃N@C₈₀, has been determined. The crystallographic data shows that cycloaddition occurs at a C-C bond of 6:5 ring junction, and that the fullerene C1-C2 bond is elongated and pulled out from the fullerene. The Sc₃N unit is well-ordered within the C₈₀ cage and positioned away from the site of addition. The proximity of the Sc atoms to the cage carbon atoms causes those carbon atoms to protrude slightly from the surface of the fullerene cage.

Original language	English
Pages (from-to)	3494-3495
Number of pages	2
Journal	Journal of the American Chemical Society
Volume	124
Issue number	14
DOIs	https://doi.org/10.1021/ja020065x
Publication status	Published - 2002 Apr 10

All Science Journal Classification (ASJC) codes

Catalysis
Chemistry(all)
Biochemistry
Colloid and Surface Chemistry

Access to Document

10.1021/ja020065x

Fingerprint Dive into the research topics of 'Crystallographic characterization and structural analysis of the first organic functionalization product of the endohedral fullerene Sc<sub>3</sub>N@C<sub>80</sub>'. Together they form a unique fingerprint.

Cite this

@article{35472a4842f54baebc868152e66bb749,

title = "Crystallographic characterization and structural analysis of the first organic functionalization product of the endohedral fullerene Sc3N@C80",

abstract = "The structure of Sc3N@C80-C10H12O2, a Diels-Alder cycloadduct of Sc3N@C80, has been determined. The crystallographic data shows that cycloaddition occurs at a C-C bond of 6:5 ring junction, and that the fullerene C1-C2 bond is elongated and pulled out from the fullerene. The Sc3N unit is well-ordered within the C80 cage and positioned away from the site of addition. The proximity of the Sc atoms to the cage carbon atoms causes those carbon atoms to protrude slightly from the surface of the fullerene cage.",

author = "Lee, {Hon Man} and Olmstead, {Marilyn M.} and Erick Iezzi and Duchamp, {James C.} and Dorn, {Harry C.} and Balch, {Alan L.}",

year = "2002",

month = apr,

day = "10",

doi = "10.1021/ja020065x",

language = "English",

volume = "124",

pages = "3494--3495",

journal = "Journal of the American Chemical Society",

issn = "0002-7863",

publisher = "American Chemical Society",

number = "14",

}

Crystallographic characterization and structural analysis of the first organic functionalization product of the endohedral fullerene Sc₃N@C₈₀. / Lee, Hon Man; Olmstead, Marilyn M.; Iezzi, Erick; Duchamp, James C.; Dorn, Harry C.; Balch, Alan L.

In: Journal of the American Chemical Society, Vol. 124, No. 14, 10.04.2002, p. 3494-3495.

Research output: Contribution to journal › Article › peer-review

TY - JOUR

T1 - Crystallographic characterization and structural analysis of the first organic functionalization product of the endohedral fullerene Sc3N@C80

AU - Lee, Hon Man

AU - Olmstead, Marilyn M.

AU - Iezzi, Erick

AU - Duchamp, James C.

AU - Dorn, Harry C.

AU - Balch, Alan L.

PY - 2002/4/10

Y1 - 2002/4/10

N2 - The structure of Sc3N@C80-C10H12O2, a Diels-Alder cycloadduct of Sc3N@C80, has been determined. The crystallographic data shows that cycloaddition occurs at a C-C bond of 6:5 ring junction, and that the fullerene C1-C2 bond is elongated and pulled out from the fullerene. The Sc3N unit is well-ordered within the C80 cage and positioned away from the site of addition. The proximity of the Sc atoms to the cage carbon atoms causes those carbon atoms to protrude slightly from the surface of the fullerene cage.

AB - The structure of Sc3N@C80-C10H12O2, a Diels-Alder cycloadduct of Sc3N@C80, has been determined. The crystallographic data shows that cycloaddition occurs at a C-C bond of 6:5 ring junction, and that the fullerene C1-C2 bond is elongated and pulled out from the fullerene. The Sc3N unit is well-ordered within the C80 cage and positioned away from the site of addition. The proximity of the Sc atoms to the cage carbon atoms causes those carbon atoms to protrude slightly from the surface of the fullerene cage.

UR - http://www.scopus.com/inward/record.url?scp=0037051642&partnerID=8YFLogxK

UR - http://www.scopus.com/inward/citedby.url?scp=0037051642&partnerID=8YFLogxK

U2 - 10.1021/ja020065x

DO - 10.1021/ja020065x

M3 - Article

C2 - 11929224

AN - SCOPUS:0037051642

VL - 124

SP - 3494

EP - 3495

JO - Journal of the American Chemical Society

JF - Journal of the American Chemical Society

SN - 0002-7863

IS - 14

ER -