Analysis of proton-proton transfer dynamics in rotating solids and their use for 3D structure determination

Adam Lange, Karsten Seidel, Laurent Verdier, Sorin Luca, Marc Baldus

Research output: Contribution to journalArticle

120 Citations (Scopus)

Abstract

A detailed analysis of proton-proton-transfer dynamics under magic angle spinning NMR is presented. Results obtained on model compounds are evaluated under different experimental conditions and NMR mixing schemes. It is shown that the resulting buildup rates can be interpreted in terms of internuclear proton-proton distances provided that an appropriate theoretical description is chosen. As demonstrated in two test applications, these dependencies can be used in the context of a three-dimensional structure determination in the solid state.

Original languageEnglish (US)
Pages (from-to)12640-12648
Number of pages9
JournalJournal of the American Chemical Society
Volume125
Issue number41
DOIs
StatePublished - Oct 15 2003

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Proton transfer
Protons
Nuclear magnetic resonance
Magic angle spinning

ASJC Scopus subject areas

  • Catalysis
  • Chemistry(all)
  • Biochemistry
  • Colloid and Surface Chemistry

Cite this

Analysis of proton-proton transfer dynamics in rotating solids and their use for 3D structure determination. / Lange, Adam; Seidel, Karsten; Verdier, Laurent; Luca, Sorin; Baldus, Marc.

In: Journal of the American Chemical Society, Vol. 125, No. 41, 15.10.2003, p. 12640-12648.

Research output: Contribution to journalArticle

Lange, Adam ; Seidel, Karsten ; Verdier, Laurent ; Luca, Sorin ; Baldus, Marc. / Analysis of proton-proton transfer dynamics in rotating solids and their use for 3D structure determination. In: Journal of the American Chemical Society. 2003 ; Vol. 125, No. 41. pp. 12640-12648.
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