User menu

Accès à distance ? S'identifier sur le proxy UCLouvain

Retrosynthetic analysis of fullerene C-60: Structure, stereochemistry, and calculated stability of C-30 fragments

Primary tabs

Geneste, F Moradpour, A Dive, G. Peeters, Daniel [UCL] Malthete, J Sadoc, JF

The total number of possible retrosynthetic bisections Of C-60 leads to nine different isometric C-30 fragments. These molecules include five chiral units, four of which derive from partitions corresponding to four distinct "Coupes du Roi". The energies, curvatures, and homodesmotic stabilization energies of the C-30 fragments are evaluated at the ab initio 6-31G level.

Document type Article de périodique (Journal article) – Article de recherche
Access type Accès restreint
Publication date 2002
Language Anglais
Journal information "The Journal of Organic Chemistry" - Vol. 67, no. 2, p. 605-607 (2002)
Peer reviewed yes
Publisher Amer Chemical Soc (Washington)
issn 0022-3263
e-issn 1520-6904
Publication status Publié
Affiliation UCL
Links
Bibliographic reference Geneste, F ; Moradpour, A ; Dive, G. ; Peeters, Daniel ; Malthete, J ; et. al. Retrosynthetic analysis of fullerene C-60: Structure, stereochemistry, and calculated stability of C-30 fragments. In: The Journal of Organic Chemistry, Vol. 67, no. 2, p. 605-607 (2002)
Permanent URL http://hdl.handle.net/2078.1/42179