Cooperative Cluster Metalation and Ligand Migration in Zirconium Metal–Organic Frameworks

Abstract

Cooperative cluster metalation and ligand migration were performed on a Zr‐MOF, leading to the isolation of unique bimetallic MOFs based on decanuclear Zr6M4 (M=Ni, Co) clusters. The M2+ reacts with the μ3‐OH and terminal H2O ligands on an 8‐connected [Zr6O4(OH)8(H2O)4] cluster to form a bimetallic [Zr6M4O8(OH)8(H2O)8] cluster. Along with the metalation of Zr6 cluster, ligand migration is observed in which a Zr–carboxylate bond dissociates to form a M–carboxylate bond. Single‐crystal to single‐crystal transformation is realized so that snapshots for cooperative cluster metalation and ligand migration processes are captured by successive single‐crystal X‐ray structures. In3+ was metalated into the same Zr‐MOF which showed excellent catalytic activity in the acetaldehyde cyclotrimerization reaction. This work not only provides a powerful tool to functionalize Zr‐MOFs with other metals, but also structurally elucidates the formation mechanism of the resulting heterometallic MOFs.

Document Details

Document Type
Pub Defense Publication
Publication Date
Oct 23, 2015
Source ID
10.1002/ange.201505625

Entities

People

  • Hong‐cai Zhou
  • Junsheng Qin
  • Mathieu Bosch
  • Qiang Zhang
  • Shuai Yuan
  • Tian‐fu Liu
  • Weigang Lu
  • Xizhen Lian
  • Xuan Wang
  • Ying‐pin Chen

Organizations

  • National Science Foundation
  • Office of Naval Research
  • Robert A. Welch Foundation
  • United States Department of Energy

Tags

Fields of Study

  • Chemistry

Readers

  • Molecular and Cellular Biochemistry
  • Parallel and Distributed Computing.
  • Powder metallurgy of Titanium alloys.