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The fluorine atom as a halogen bond donor, viz. a positive site
Abstract
When bound to residues which can work as particularly strong electron withdrawing groups, fluorine can display a region of positive electrostatic potential (positive σ-hole). Fluorine can thus function as a halogen bond donor and form complexes with lone-pair-containing neutral atoms and anions. Examples in the gas, liquid, and solid phases are discussed.
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Citations
Cited by
σ-Hole Bond vs π-Hole Bond: A Comparison Based on Halogen Bond
Wang, H., Wang, W., & Jin, W. J. (2016) · Chemical Reviews · doi:10.1021/acs.chemrev.5b00527 · Cited by 631
Halogen Bonds: Benchmarks and Theoretical Analysis
Kozuch, S., & Martin, J. M. L. (2013) · Journal of Chemical Theory and Computation · doi:10.1021/ct301064t · Cited by 553
Computational tools to model halogen bonds in medicinal chemistry.
Ford, M. C., & Ho, P. S. (2016) · Journal of Medicinal Chemistry · doi:10.1021/acs.jmedchem.5b00997 · Cited by 143
Metadata
- Authors
- Metrangolo, P., Murray, J. S., Pilati, T., Politzer, P., Resnati, G., & Terraneo, G.
- Venue
- CrystEngComm
- Publisher
- Royal Society of Chemistry (RSC)
- Published
- 2011
- Volume
- 13
- Issue
- 22
- Pages
- 6593
- ISSN
- 1466-8033 (ISSN-L)
- OpenAlex
- W2070914359
- Cited by
- 247
- References
- 0
- FWCI
- 15.94
- Type
- journal article
- Language
- en
- Open access
- closed
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- CoChat. (2026). Citation check: The fluorine atom as a halogen bond donor, viz. a positive site. https://app.cochat.ai/papers/10.1039/c1ce05554b
- The paper
- Metrangolo, P., Murray, J. S., Pilati, T., Politzer, P., Resnati, G., & Terraneo, G. (2011). The fluorine atom as a halogen bond donor, viz. a positive site. CrystEngComm. https://doi.org/10.1039/c1ce05554b
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Bibliographic data: Semantic Scholar, OpenAlex, Crossref.
Contains information from the Semantic Scholar Academic Graph Datasets, made available under the ODC Attribution License (ODC-BY 1.0).
Semantic Scholar’s data is described in: Kinney, R., et al. (2023). The Semantic Scholar Open Data Platform. arXiv:2301.10140.