From statistical mixtures to structural insights: characterisation of heterometallic [M4L6]8+ coordination cages
Fangxing Hong1, Michael C Pfrunder2,1, David L Marshall2,3
1School of Chemistry and Physics Queensland University of Technology, 2 George Street, Brisbane, Queensland 4000, Australia.
Abstract:
Using high-resolution ion mobility-mass spectrometry (IM-MS), we demonstrate the resolution and characterisation of heterobimetallic [M4L6]8+ coordination cages, enabling the identification and interrogation of individual mixed metal assemblies from complex mixtures. IM-MS guided synthesis represents a paradigm shift in the development of supramolecular sensors and catalysts that embrace complexity rather than exclusively pure materials.
Related Concept Videos
Valence Bond Theory
Crystal Field Theory - Octahedral Complexes
To explain the observed behavior of transition metal complexes (such as colors), a model involving electrostatic interactions between the electrons from the ligands and the electrons in the unhybridized d orbitals of the central metal atom has been developed. This electrostatic model is crystal field theory (CFT). It helps to understand, interpret, and predict the colors, magnetic behavior, and some structures of coordination compounds of transition metals.
CFT focuses on...
High-Resolution Mass Spectrometry (HRMS)
Crystal Field Theory - Tetrahedral and Square Planar Complexes
Crystal field theory (CFT) is applicable to molecules in geometries other than octahedral. In octahedral complexes, the lobes of the dx2−y2 and dz2 orbitals point directly at the ligands. For tetrahedral complexes, the d orbitals remain in place, but with only four ligands located between the axes. None of the orbitals points directly at the tetrahedral ligands. However, the dx2−y2 and dz2 orbitals (along the Cartesian axes) overlap with the ligands less than...
Colors and Magnetism
When atoms or molecules absorb light at the proper frequency, their electrons are excited to higher-energy orbitals. For many main group atoms and molecules, the absorbed photons are in the ultraviolet range of the electromagnetic spectrum, which cannot be detected by the human eye. For coordination compounds, the energy difference between the d orbitals often allows photons in the visible range to be absorbed and emitted, which is seen as colors by the human...
Metal-Ligand Bonds
In these complexes, transition metals form coordinate covalent bonds, a kind of Lewis acid-base interaction in which both of the electrons in the bond are contributed by a donor (Lewis base) to an electron acceptor (Lewis acid). The Lewis acid in...


