Electron transitions in a Ce(iii)-catecholate metal-organic framework

Julia G. Knapp, Debmalya Ray, Paul B. Calio, Megan C. Wasson, Thais R. Scott, Laura Gagliardi, Omar K. Farha

Research output: Contribution to journalArticlepeer-review

5 Scopus citations

Abstract

A rare three-dimensional catecholate-based Ce(iii) metal-organic framework (MOF), denoted as NU-1701, has been synthesized and crystallographically characterized. Density functional theory calculations highlight various possible electronic transitions that may present in NU-1701. These transitions are competitive and indicate increased lanthanide character of Ce(iii).

Original languageEnglish
Pages (from-to)525-528
Number of pages4
JournalChemical Communications
Volume58
Issue number4
DOIs
StatePublished - Jan 14 2022
Externally publishedYes

Funding

The authors acknowledge support from the U.S. Department of Energy, National Nuclear Security Administration, under Award Number DE-NA0003763. J. G. K. and M. C. W. acknowledge support from the National Science Foundation Graduate Research Fellowship under Award Number DGE-1842165. T. R. S. acknowledges that this material is based upon work supported by the National Science Foundation Graduate Research Fellowship Program under Grant No. CON-75851, project 00074041. This work made use of the IMSERC Crystallography and NMR facilities at Northwestern University, which have received support from the Soft and Hybrid Nanotechnology Experimental (SHyNE) Resource (NSF ECCS-2025633), and Northwestern University. This work made use of the Keck-II facility of Northwestern University’s NUANCE Center, which has received support from the SHyNE Resource (NSF ECCS-2025633), the IIN, and Northwestern’s MRSEC program (NSF DMR-1720139).

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