1JCH couplings in Group 14/IVA tetramethyls from the gas-phase NMR and DFT structural study: a search for the best computational protocol-Reference-Cited by-同舟云学术

1JCH couplings in Group 14/IVA tetramethyls from the gas-phase NMR and DFT structural study: a search for the best computational protocol

Published:2014 Issue:29 Volume:16 Page:15699-15708
ISSN:1463-9076
Container-title:Phys. Chem. Chem. Phys.
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Nazarski Ryszard B.¹²³⁴,Makulski Włodzimierz⁵²⁶⁷

Affiliation:

1. Laboratory of Molecular Spectroscopy

2. Faculty of Chemistry

3. University of Łódź

4. 91-403 Łódź, Poland

5. Laboratory of NMR Spectroscopy

6. University of Warsaw

7. 02-093 Warsaw, Poland

Abstract

The gas-phase ¹J_0,CHs in ‘isolated’ molecules of EMe₄ were determined and discussed in terms of their geometric/electronic properties obtained from DFT calculations.

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2014/CP/C4CP01596G

Reference78 articles.

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