X-ray optical activity in 4d and 5d metal complexes

DOI

The aim of this proposal is to elucidate the role of p-d orbital hybridization on the X-ray Natural Circular Dichroism (XNCD) response. In this project, we will acquire original experimental data to validate theory and use in the development of tools to simulate XNCD spectra to open this technique to the chemistry community. The proposed systems consist of single crystals containing the group 7 metals − cobalt, rhodium and iridium − measured at the metal K- and L- edges. The chosen chiral molecules, M(chxn)33٠3H2O, provide isostructural models where the only change is the valence d shell, going from 3d in cobalt to 5d in iridium. We hypothesize that the more diffuse d orbitals in the heavier metals will result in a larger p-d hybridization and thus a larger relative XNCD response.

Identifier
DOI https://doi.org/10.15151/ESRF-ES-2032078535
Metadata Access https://icatplus.esrf.fr/oaipmh/request?verb=GetRecord&metadataPrefix=oai_datacite&identifier=oai:icatplus.esrf.fr:inv/2032078535
Provenance
Creator Nathan YUTRONKIE ORCID logo; Elizabeth HILLARD; Nazanin KORDESTANI MAHANI (ORCID: 0000-0001-5108-920X); Amélie JUHIN; Marie-Anne ARRIO
Publisher ESRF (European Synchrotron Radiation Facility)
Publication Year 2028
Rights CC-BY-4.0; https://creativecommons.org/licenses/by/4.0
OpenAccess true
Representation
Resource Type Data from large facility measurement; Collection
Discipline Particles, Nuclei and Fields