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Joint spectroscopic and theoretical investigations of transition metal complexes involving non-innocent ligands
Abstract
A series of transition metal complexes involving non-innocent o-dithiolene and o-phenylenediamine ligands has been characterized in detail by various spectroscopic methods like magnetic circular dichroism (MCD), absorption (abs), resonance Raman (rR), electron paramagnetic resonance (EPR), and sulfur K-edge X-ray absorption spectroscopies. A computational model for the electronic structure of the complexes is then proposed based on the density functional theory (DFT) or ab-initio methods, which can successfully account for the observed trends in the experimental spectra (MCD, rR, and abs) of the complexes. Based on these studies, the innocent vs non-innocent nature of the ligands in a given transition metal complex is found to be dependent on the position of the central metal ion in the periodic table, its effective nuclear charge in interplay with relativistic effects.
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Cites
The mononuclear molybdenum enzymes
Hille, R., Hall, J., & Basu, P. (2014) · Chemical Reviews · doi:10.1021/cr400443z · Cited by 1,738
The Mononuclear Molybdenum Enzymes
Hille, R. (1996) · Chemical Reviews · doi:10.1021/cr950061t · Cited by 1,501
Cited by
Manifestations of Noninnocent Ligand Behavior
Kaim, W. (2011) · Inorganic Chemistry · doi:10.1021/ic2003832 · Cited by 498
Malrieu, J. P., Caballol, R., Calzado, C. J., de Graaf, C., & Guihéry, N. (2014) · Chemical Reviews · doi:10.1021/cr300500z · Cited by 434
Schneider, S., Meiners, J., & Askevold, B. (2012) · European Journal of Inorganic Chemistry · doi:10.1002/ejic.201100880 · Cited by 276
Lu, C. C., Bill, E., Weyhermüller, T., Bothe, E., & Wieghardt, K. (2008) · Journal of the American Chemical Society · doi:10.1021/ja710663n · Cited by 272
Self-citationRedox Control of Aluminum Ring-Opening Polymerization: A Combined Experimental and DFT Investigation
Wei, J., Riffel, M. N., & Diaconescu, P. L. (2017) · Macromolecules · doi:10.1021/acs.macromol.6b02402 · Cited by 76
Metadata
- Authors
- Ray, K., Petrenko, T., Wieghardt, K., & Neese, F.
- Venue
- Dalton Transactions
- Publisher
- Royal Society of Chemistry (RSC)
- Published
- 2007
- Issue
- 16
- Pages
- 1552
- ISSN
- 1477-9226 (ISSN-L)
- 1477-9234
- OpenAlex
- W2114953205
- Cited by
- 322
- References
- 2
- FWCI
- 15.75
- Type
- journal article
- Language
- en
- Open access
- closed
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- Ray, K., Petrenko, T., Wieghardt, K., & Neese, F. (2007). Joint spectroscopic and theoretical investigations of transition metal complexes involving non-innocent ligands. Dalton Transactions. https://doi.org/10.1039/b700096k
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