Activation of H<sub>2</sub> using <i>ansa</i>-aminoboranes: solvent effects, dynamics, and spin hyperpolarization-Reference-Cited by-同舟云学术

Activation of H₂ using ansa-aminoboranes: solvent effects, dynamics, and spin hyperpolarization

Published:2024 Issue:4 Volume:26 Page:3197-3207
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Konsewicz Karolina¹,Laczkó Gergely²³,Pápai Imre²^ORCID,Zhivonitko Vladimir V.¹^ORCID

Affiliation:

1. NMR Research Unit, Faculty of Science, University of Oulu, P.O. Box 3000, Oulu, 90014, Finland

2. Institute of Organic Chemistry, Research Centre for Natural Sciences, Magyar Tudósok Körútja 2, H-1117 Budapest, Hungary

3. Hevesy György PhD School of Chemistry, Eötvös Loránd University, P.O. Box 32, H-1518 Budapest, Hungary

Abstract

We present an experimental-computational study of metal-free H2 activation by ansa-aminoboranes in various solvents, including molecular level dynamics, thermochemistry, and spin hyperpolarization PHIP effects in the activation of parahydrogen.

Funder

Kvantum-instituutti, Oulun Yliopisto

Academy of Finland

Nemzeti Kutatási Fejlesztési és Innovációs Hivatal

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2024/CP/D3CP05816F

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5. Spontaneous 15N Nuclear Spin Hyperpolarization in Metal-Free Activation of Parahydrogen by Molecular Tweezers