Inside Cover: Natural Abundance 15N and 13C Solid-State NMR Chemical Shifts: High Sensitivity Probes of the Halogen Bond Geometry (Chem. Eur. J. 47/2016)

Cerreia Vioglio, Paolo; Catalano, Luca; Vasylyeva, Vera; Nervi, Carlo; R. Chierotti, Michele; Resnati, Giuseppe; Gobetto, Roberto; Metrangolo, Pierangelo

Abstract

Natural abundance 15N solid-state NMR spectroscopy provides an effective method for the direct evaluation of halogen bond (XB) geometry. The change in the 15N SSNMR chemical shifts in halogen-bonded co-crystals of different dipyridyl derivatives with halobenzenes and diiodoalkanes as XB-donors is generally greater than 13C chemical shifts and it is shown to experimentally correlate with the normalized distance parameter of the XB. The same overall trend is confirmed by DFT calculations of the chemical shifts. More information can be found in the Full Paper by R. Gobetto, P. Metrangolo et al.

Citation

Cerreia Vioglio, P., Catalano, L., Vasylyeva, V., Nervi, C., R. Chierotti, M., Chierotti, M., Resnati, G., Gobetto, R., & Metrangolo, P. (2016). Inside Cover: Natural Abundance 15N and 13C Solid-State NMR Chemical Shifts: High Sensitivity Probes of the Halogen Bond Geometry (Chem. Eur. J. 47/2016). Chemistry - A European Journal, 22(47), 16694-16694. https://doi.org/10.1002/chem.201604244

• Journal Article Type: Other
• Online Publication Date: Oct 10, 2016
• Publication Date: Nov 14, 2016
• Deposit Date: Nov 18, 2024
• Journal: Chemistry - A European Journal
• Print ISSN: 0947-6539
• Electronic ISSN: 1521-3765
• Publisher: Wiley
• Peer Reviewed: Peer Reviewed
• Volume: 22
• Issue: 47
• Pages: 16694-16694
• DOI: https://doi.org/10.1002/chem.201604244
• Public URL: https://nottingham-repository.worktribe.com/output/42198765
• Publisher URL: https://chemistry-europe.onlinelibrary.wiley.com/doi/10.1002/chem.201604244