Observability of paramagnetic NMR signals at over 10 000 ppm chemical shifts

e-pub ahead of print date: 5 August 2021

Published date: 11 October 2021

Additional Information: Funding Information: The authors thank Heidelberg University for funding this work and acknowledge support by the state of Baden-W?rttemberg through bwHPC and the German Research Foundation through Grant INST 40/575-1 FUGG (JUSTUS 2 cluster). We thank Dr. Bernd Simon (European Molecular Biology Laboratory, Heidelberg) for the provision of measuring time at the 800 MHz NMR spectrometer. We thank Dr. Thomas Lohmiller, Dr. Karsten Holldack and Dirk Ponnwitz (HZB) for help with the FD-FT THz-EPR measurements at BESSY II, Andreas G?bels (MPI CEC) for conducting the SQUID magnetometry measurements and Dr. Eckhard Bill (MPI CEC) for making available a program for the simulation of SQUID magnetometry data and help with the data interpretation. Allocation of FD-FT THz-EPR beam time by Helmholtz Zentrum Berlin f?r Materialien und Energie (HZB) is gratefully acknowledged. EAS thanks the University of Bath HPC facility for the computational resources. Open access funding enabled and organized by Projekt DEAL. Funding Information: The authors thank Heidelberg University for funding this work and acknowledge support by the state of Baden‐Württemberg through bwHPC and the German Research Foundation through Grant INST 40/575‐1 FUGG (JUSTUS 2 cluster). We thank Dr. Bernd Simon (European Molecular Biology Laboratory, Heidelberg) for the provision of measuring time at the 800 MHz NMR spectrometer. We thank Dr. Thomas Lohmiller, Dr. Karsten Holldack and Dirk Ponnwitz (HZB) for help with the FD‐FT THz‐EPR measurements at BESSY II, Andreas Göbels (MPI CEC) for conducting the SQUID magnetometry measurements and Dr. Eckhard Bill (MPI CEC) for making available a program for the simulation of SQUID magnetometry data and help with the data interpretation. Allocation of FD‐FT THz‐EPR beam time by Helmholtz Zentrum Berlin für Materialien und Energie (HZB) is gratefully acknowledged. EAS thanks the University of Bath HPC facility for the computational resources. Open access funding enabled and organized by Projekt DEAL. Publisher Copyright: © 2021 The Authors. Angewandte Chemie International Edition published by Wiley-VCH GmbH

Keywords: Paramagnetic NMR, hydrido complex, magnetic anisotropy, paramagnetic relaxation enhancement, terahertz electron paramagnetic resonance

Local EPrints ID: 451113

URI: http://eprints.soton.ac.uk/id/eprint/451113

DOI: doi:10.1002/anie.202107944

ISSN: 1433-7851

PURE UUID: 0709fce9-e258-4fdd-b604-8986ad7acd0f

ORCID for Ilya Kuprov: orcid.org/0000-0003-0430-2682

Date deposited: 08 Sep 2021 16:30

Last modified: 28 Aug 2024 01:45