Pan-European solid-state NMR Infrastructure for Chemistry-Enabling Access

Koppe. J; Sanders. K; Robinson. T; Lejeune. A; Proriol. A; Wegner. S; Purea. A; Engelke. F; Clément. R; Grey. C; Pell. A; Pintacuda. G, "Resolving Structures of Paramagnetic Systems in Chemistry and Materials Science by Solid-State NMR: the Revolving Power of Ultra-Fast MAS"
Angewandte Chemie International Edition Vol.64, , 1
DOI: 10.1002/anie.202408704
Open access: https://doi.org/10.1002/anie.202408704
Raw data: https://zenodo.org/records/11120901

Steinberg, Y., Sebti, E., Moroz, I.B., et al., "Composition and Structure of the solid electrolyte interphase on Na-Ion Anodes Revealed by Exo- and Endogenous Dynamic Nuclear Polarization─NMR Spectroscopy"
J. Am. Chem. Soc
DOI: 10.1021/jacs.4c06823
Open access: https://pubs.acs.org/doi/10.1021/jacs.4c06823
Raw data: https://doi.org/10.34933/46bd9e52-9e84-4c02-bb5e-e332a6296a7d

Z. Wan, M. Shi, Y. Q. Gong, M. Lucci, J. J. Li, J. H. Zhou, X. L. Yang, M. Lelli, X. He and J. F. Mao, "Multitasking Pharmacophores Support Cabotegravir-Based Long-Acting HIV Pre-Exposure Prophylaxis (PrEP)"
Molecules
DOI: 10.3390/molecules29020376
Open access: https://www.mdpi.com/1420-3049/29/2/376
Raw data: Pending

Holmes, J.B., Torodii, D., Balodis, M., Cordova, M., Hofstetter, A., Paruzzo, F., Lill, S.O.N., Eriksson, E., Berruyer, P., Almeida, B.S. de, Quayle, M., Norberg, S., Ankarberg, A.S., Schantz, S., Emsley, L, "Atomic-level structure of the amorphous drug atuliflapon via NMR crystallography"
Chem. Sci
DOI: 10.1039/D4FD00078A
Open access: https://pubs.rsc.org/en/content/articlelanding/2024/fd/d4fd00078a
Raw data: https://doi.org/10.24435/materialscloud:9r-b9

A. Gabbani, E. Della Latta, A. Mohan, A. Scarperi, X. Y. Li, M. Ruggeri, F. Martini, F. Biccari, M. Kociak, M. Geppi, S. Borsacchi and F. Pineider, "Direct Determination of Carrier Parameters in Indium Tin Oxide Nanocrystals"
Acs Nano
DOI: 10.1021/acsnano.4c02875
Open access: https://pubs.acs.org/doi/10.1021/acsnano.4c02875
Raw data: Pending

Fykouras, K.; Lahnsteiner, J.; Leupold, N.; Tinnemans, P.; Moos, R.; Panzer, F.; Wijs, G. A. de; Bokdam, M.; Grüninger, H.; Kentgens, A. P. M, "Disorder to Order: How Halide Mixing in MAPbI3−xBrx Perovskites Restricts MA Dynamics"
J. Mater. Chem. A
DOI: 10.1039/D2TA0 9069D
Open access: https://pubs.rsc.org/en/content/articlepdf/2023/ta/d2ta09069d
Raw data: https://doi.org/10.34973/f550-9765

?imko, F.; Rakhmatullin, A.; King, G.; Allix, M.; Bessada, C.; Netriov, Z.; Krishnan, D.; Korenko, M, "Cesium Oxo-Fluoro-Aluminates in the CsF-Al2O3 System: Synthesis and Structural Characterization"
Inorg. Chem
DOI: 10.1021/acs.ino rgchem.3c0238 6

R. Shukla, A. J. Peoples, K. C. Ludwig, S. Maity, M. G. N. Derks, S. D. Benedetti, A. M. Krueger, B. J. A. Vermeulen, T. Harbig, F. Lavore, R. Kumar, R. Honorato, F. Grein, K. Nieselt, Y. P. Liu, A. Bonvin, M. Baldus, U. Kubitscheck, E. Breukink, C. Achor, "An antibiotic from an uncultured bacterium binds to an immutable target"
Cell
DOI: 186.10.1016/j.cell.2023.07.038
Open access: https://pubmed.ncbi.nlm.nih.gov/37611581
Raw data: https://zenodo.org/records/7075976

Venkatesh, A.; Casano, G.; Rao, Y.; De Biasi, F.; Perras, F. A.; Kubicki, D. J.; Siri, D.; Abel, S.; Karoui, H.; Yulikov, M.; Ouari, O.; Emsley, L, "Deuterated TEKPol Biradicals and the Spin-Diffusion Barrier in MAS DNP"
Angewandte Chemie International edition Vol.63, , 31
DOI: 10.1002/anie.202304844
Open access: https://onlinelibrary.wiley.com/doi/10.1002/anie.202304844
Raw data: https://zenodo.org/records/7955264

Menzildjian, G; Schlagnitweit, J; Casano, G; Ouari, O; Gajan, D; Lesage, A., Judith Schlagnitweit, Gilles Casano, Olivier Ouari, David Gajan, "Polarizing agents for efficient high field DNP solidstate NMR spectroscopy under magic-angle spinning: from design principles to formulation strategies"
Chem". Sci Vol.14, 6120-6148
DOI: 10.1039/D3SC01079A
Open access: https://pubs.rsc.org/en/content/articlepdf/2023/sc/d3sc01079a

Jabbour, R; Ashling, C; Robinson, T; Khan, A; Wisser, D; Berruyer, P; Ghosh, A; Ranscht, A; Keen, D, Christopher W.Ashling, Thomas C.Robinson, Arafat Hossain Khan, Dorothea Wisser, "Unravelling the Molecular Structure and Confining Environment of an Organometallic Catalyst Heterogenized within Amorphous Porous Polymers"
gew. Chem. Int. Ed Vol.62, 1-9, 62
DOI: 10.1002/anie.202310878
Open access: https://onlinelibrary.wiley.com/doi/epdf/10.1002/anie.202310878
Raw data: https://doi.org/10.5281/zenodo.13981693

Poulhazan, A; Baer, A; Daliaho, G; Arnold, A; Browne, D; Hering, L; Archer-Hartmann, S; Pepi, L, Alexander Baer, Gagan Daliaho, Frederic Mentink-Vigier, Alexandre A. Arnold, "Peculiar Phosphonate Modifications of Velvet Worm Slime Revealed by Advanced Nuclear Magnetic Resonance and Mass Spectrometry"
J. Am. Chem. Soc Vol.145, 20749-20754, 38
DOI: 10.1021/jacs.3c06798
Open access: https://pubs.acs.org/doi/abs/10.1021/jacs.3c06798
Raw data: https://zenodo.org/records/13646295

I. Goldberga, N. D. Jensen, C. Combes, F. Mentink-Vigier, X. L. Wang, "17O solid state NMR as a valuable tool for deciphering reaction mechanisms in mechanochemistry: the case study on the 17O-enrichment of hydrated Ca-pyrophosphate biominerals"
Faraday Discuss
DOI: 10.1039/d2fd00127f
Open access: https://pubs.rsc.org/en/content/articlelanding/2022/fd/d2fd00127f
Raw data: https://doi.org/10.5281/zenodo.7778251

Halbritter, T.; Harrabi, R.; Paul, S.; Tol, J. van; Lee, D.; Hediger, S.; Sigurdsson, S. T.; Mentink-Vigier, F.; Paëpe, G. D, R. Harrabi, S. Paul, J. Van Tol, D. Lee, "PyrroTriPol: A Semi-Rigid Trityl-Nitroxide for High Field Dynamic Nuclear Polarization"
Chem. Sci Vol.4 , 3852-3864, 14
DOI: 10.1039/D2SC05880D
Open access: https://pubs.rsc.org/en/content/articlelanding/2023/sc/d2sc05880d
Raw data: https://www.rsc.org/suppdata/d2/sc/d2sc05880d/d2sc05880d1.pdf

Afrough, A., Christensen, N.V., Jensen, R.W.M., Juhl, D.W., Vosegaard, T, "Magic angle spinning effects on longitudinal NMR relaxation: 15N in L-histidine"
AIP Advances.
DOI: 10.1063/5.0177246
Open access: https://arxiv.org/pdf/2310.03029
Raw data: https://doi.org/10.5281/zenodo.8363603