Measuring multiple 17O–13C J-couplings in naphthalaldehydic acid: a combined solid state NMR and density functional theory approach-Reference-Cited by-同舟云学术

Measuring multiple 17O–13C J-couplings in naphthalaldehydic acid: a combined solid state NMR and density functional theory approach

Published:2020 Issue:6 Volume:22 Page:3400-3413
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Rees Gregory J.¹²³⁴^ORCID,Day Stephen P.¹²³⁴^ORCID,Barnsley Kristian E.¹²³⁴,Iuga Dinu¹²³⁴^ORCID,Yates Jonathan R.⁵⁶⁷⁴^ORCID,Wallis John D.⁸⁹¹⁰⁴^ORCID,Hanna John V.¹²³⁴^ORCID

Affiliation:

1. Department of Physics

2. University of Warwick

3. Coventry

4. UK

5. Department of Materials

6. Oxford University

7. Oxford

8. School of Science and Technology

9. Nottingham Trent University

10. Nottingham

Abstract

A combined multinuclear solid-state NMR and a density functional theory computational approach, with SIMPSON simulations, is evaluated to determine the four heteronuclear ¹J(¹³C,¹⁷O) couplings in naphthalaldehydic acid.

Funder

Engineering and Physical Sciences Research Council

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2020/CP/C9CP03977E

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