The physical separation of CH from CO on metal-organic frameworks (MOFs) has received a substantial amount of research interest due to its advantages of simplicity, security, and energy efficiency. However, the exploitation of ideal MOF adsorbents for CH/CO separation remains a challenging task due to their similar physical properties and molecular sizes. Herein, we report a unique CH nano-trap constructed using accessible oxygen and nitrogen sites, which exhibits energetic favorability toward CH molecules. This material exhibits a good acetylene capacity of 55.31 cm g and high CH/CO selectivity of 7.0 under ambient conditions. We have combined IR spectroscopy and in-depth theoretical calculations to unravel the synergistic interactions driven by the high density of accessible oxygen and nitrogen sites. Furthermore, dynamic breakthrough experiments confirmed the capability of TUTJ-201Ni for the separation of binary CH/CO mixtures. This study on Ni-based MOFs will enrich Lewis basic site rich MOFs for gas adsorption and separation applications.

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http://dx.doi.org/10.1039/d4dt03411bDOI Listing

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