Measurement of interfluorine distances in solids

Citation
Ml. Gilchrist et al., Measurement of interfluorine distances in solids, J MAGN RES, 152(1), 2001, pp. 1-6
Citations number
19
Categorie Soggetti
Chemistry & Analysis","Physical Chemistry/Chemical Physics
Journal title
JOURNAL OF MAGNETIC RESONANCE
ISSN journal
10907807 → ACNP
Volume
152
Issue
1
Year of publication
2001
Pages
1 - 6
Database
ISI
SICI code
1090-7807(200109)152:1<1:MOIDIS>2.0.ZU;2-T
Abstract
F-19 homonuclear dipolar recoupling methods were used to measure internucle ar distances ranging from 5 to 12 Angstrom in fluorinated organic compounds in the solid state. Magic-angle-spinning-based high-resolution techniques were utilized. Trifluoromethyl and aromatic fluorine groups were seperated by rigid aromatic spacers; these compounds were diluted into nonfluorinated host molecule matrices to give isolated homonuclear spin pairs with known internuclear distances. Radiofrequency-driven recoupling (RFDR) was used to elicit magnetization exchange between the spin pairs in 1D and 2D experime nts. Simulation of the exchange was accomplished using a Monte Carlo-type a lgorithm to search the parameter space. These methods allow the determinati on of distances with an accuracy of 1 Angstrom at shorter distances and 2 A ngstrom at longer distances, with the assumption of no prior knowledge of T -2(ZQ). (C) 2001 Academic Press.