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Transition-Metal-Centered Nine-Membered Boron Rings: MⓒB9 and MⓒB9– (M = Rh, Ir)
Abstract
We report the observation of two transition-metal-centered nine-atom boron rings, RhⓒB(9)(-) and IrⓒB(9)(-). These two doped-boron clusters are produced in a laser-vaporization supersonic molecular beam and characterized by photoelectron spectroscopy and ab initio calculations. Large HOMO-LUMO gaps are observed in the anion photoelectron spectra, suggesting that neutral RhⓒB(9) and IrⓒB(9) are highly stable, closed shell species. Theoretical calculations show that RhⓒB(9) and IrⓒB(9) are of D(9h) symmetry. Chemical bonding analyses reveal that these complexes are doubly aromatic, each with six completely delocalized π and σ electrons, which describe the bonding between the central metal atom and the boron ring. This work establishes firmly the metal-doped B rings as a new class of novel aromatic molecular wheels.
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Self-consistent molecular orbital methods. XX. A basis set for correlated wave functions
Krishnan, R., Binkley, J. S., Seeger, R., & Pople, J. A. (1980) · The Journal of Chemical Physics · doi:10.1063/1.438955 · Cited by 17,772
All-boron aromatic clusters as potential new inorganic ligands and building blocks in chemistry
Alexandrova, A. N., Boldyrev, A. I., Zhai, H.-J., & Wang, L.-S. (2006) · Coordination Chemistry Reviews · doi:10.1016/j.ccr.2006.03.032 · Cited by 712
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Cited by
Understanding Boron through Size-Selected Clusters: Structure, Chemical Bonding, and Fluxionality
Sergeeva, A. P., Popov, I. A., Piazza, Z. A., Li, W.-L., Romanescu, C., Wang, L.-S., & Boldyrev, A. I. (2014) · Accounts of Chemical Research · doi:10.1021/ar400310g · Cited by 608
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Metadata
- Authors
- Li, W.-L., Romanescu, C., Galeev, T. R., Piazza, Z. A., Boldyrev, A. I., & Wang, L.-S.
- Venue
- Journal of the American Chemical Society
- Publisher
- American Chemical Society (ACS)
- Published
- 2011-12-16
- Volume
- 134
- Issue
- 1
- Pages
- 165-168
- ISSN
- 0002-7863 (ISSN-L)
- 1520-5126
- OpenAlex
- W2327027767
- Cited by
- 200
- References
- 2
- FWCI
- 8.73
- Type
- journal article
- Language
- en
- Open access
- closed
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