In this paper, we introduce two combinatorial operations and a knot-theoretical approach for generation and description of fullerene architectures. The ‘Spherical rotating–vertex bifurcation’ operation applied to original fullerene polyhedra can lead to leapfrog fullerenes. However, the ‘Spherical stretching–vertex bifurcation’ operation applied to fullerene generates a family of related polyhe...

Minimal research exists for non-chromatographic separations of rare-earth metallofullerenes containing di-metallic (M2), di-metallic carbide (M2C2), and tri-metallic nitride (M3N) clusters trapped inside fullerene cages. Herein, we demonstrate a non-HPLC method (i.e., SAFA, Stir and Filter Approach) for purifying Er3N@Ih-C80, a rare-earth, metallic nitride clusterfullerene. We describe a strate...

Reduction of scandium nitride clusterfullerene, Sc3N@Ih-C80, by sodium fluorenone ketyl in the presence of cryptand[2,2,2] allows the crystallization of the {cryptand[2,2,2](Na(+))}2(Sc3N@Ih-C80(-))2·2.5C6H4Cl2 (1) salt. The Sc3N@Ih-C80˙(-) radical anions are dimerized to form single-bonded (Sc3N@Ih-C80(-))2 dimers.

This paper is dedicated to propose an algorithm in order to generate the certain isomers of some well-known fullerene bases. Furthermore, we enlist the bipartite edge frustration correlated with some of symmetrically distinct infinite families of fullerenes generated by the offered process.

The paper reports computations on endohedral fullerene systems, combining the treatments of quantum chemistry and statistical mechanics. Relative concentrations of five isomers of Ca@C72 are presented as an illustration, using the Gibbs energy based on density-functional theory computations. Anharmonicity effects are probed on a simple model system of C6. The temperature-pressure stabilization ...

High-resolution 13C NMR has been used to structurally characterize a single isomer possessing C2 molecular symmetry as well as an inseparable mixture of other isomers of [92]fullerene, produced from dysprosium arc-burned soot, separated and isolated via multi-stage recycling HPLC.

Carbon atoms self-assemble into the famous soccer-ball shaped Buckminsterfullerene (C(60)), the smallest fullerene cage that obeys the isolated-pentagon rule (IPR). Carbon atoms self-assemble into larger (n > 60 vertices) empty cages as well-but only the few that obey the IPR-and at least 1 small fullerene (n <or= 60) with adjacent pentagons. Clathrin protein also self-assembles into small full...

Besides the conventional D5h(8149)-C70 fullerene, there are a large number of C70 isomers that violate the isolated pentagon rule (IPR). However, these non-IPR C70 fullerenes have been less investigated owing to their low stabilities or high reactivities. In this study, we report for the first time the X-ray structure of an unconventional endohedral C70 fullerene, Sc2O@C2(7892)-C70. The combine...