0000000000351560
AUTHOR
Alejandro López-moreno
Determination of association constants towards carbon nanotubes† †Electronic supplementary information (ESI) available: Synthetic details and characterization, thorough description of the method to determine the concentration of the relevant species, full set of TGA data, isotherms not shown in the main text, table with all the association constants, computational details and theoretical calibration of the nanotube length. See DOI: 10.1039/c5sc02916c
We describe a simple procedure for the determination of association constants between soluble molecules and insoluble and heterogeneous carbon nanotube samples.
Understanding Noncovalent Interactions of Small Molecules with Carbon Nanotubes
We combine experimental methods, density functional theory (DFT) calculations, and molecular dynamics (MD) simulations in the quantitative analysis of noncovalent interactions between (6,5)-enriched single-walled carbon nanotubes (SWNTs), as hosts, and a set of pyrene derivatives with different electronic properties and surface areas, as guests. The experiments and calculations were carried out in two solvents with markedly different polarities, namely 1,1',2,2'-tetrachloroethane (TCE) and N,N-dimethylformamide (DMF). Our results show that dispersion forces govern the supramolecular association of small molecules with (6,5)-SWNTs, with negligible contributions from ground-state charge-trans…
Biomimetic oxidation of pyrene and related aromatic hydrocarbons. Unexpected electron accepting abilities of pyrenequinones
We present a mild catalytic method to oxidize PAHs and, in particular, pyrene. The pyrenediones are much better electron acceptors than benzoquinone in the gas phase and present similar accepting abilities in solution.
Synthesis of flexible nanotweezers with various metals and their application in carbon nanotube extraction
Bisporphyrin-based flexible nanotweezers with various metals were synthesized and applied to the extraction of single-walled carbon nanotubes. Homo- and hetero-metallic bisporphyrins containing Co2+ were found to afford higher SWNT-extraction ability, while no or a little amount of SWNTs were extracted by bisporphyrins with other metals.
Determination of association constants towards carbon nanotubes
Single-walled carbon nanotubes (SWNTs) are one of the most promising nanomaterials and their supramolecular chemistry has attracted a lot of attention. However, despite well over a decade of research, there is no standard method for the quantification of their noncovalent chemistry in solution/suspension. Here, we describe a simple procedure for the determination of association constants (Ka) between soluble molecules and insoluble and heterogeneous carbon nanotube samples. To test the scope of the method, we report binding constants between five different hosts and two types of SWNTs in four solvents. We have determined numeric values of Ka in the range of 1–104 M−1. Solvent effects as wel…