The DOI matches its Crossref record; 3 of the 3 references it cites were found in a registry or an index.
Sigma–pi separation of the electron localization function and aromaticity
Open accessAbstract
The electron localization function (ELF) has been separated in its sigma and pi components. The topological analysis of the new ELFσ and ELFπ functions has been used to quantify the concept of resonance. The highest bifurcation values of these functions describe in a correct way the aromaticity of classical ring molecules and some new aromatic compounds as B6CO6, Al42−, and N5−. In the case of Al42−, an important σ delocalization contribution has been found, which is in agreement with previous interpretation.
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Citations
Cites
Nucleus-Independent Chemical Shifts: A Simple and Efficient Aromaticity Probe
Schleyer, P. V. R., Maerker, C., Dransfeld, A., Jiao, H., & van Eikema Hommes, N. J. R. (1996) · Journal of the American Chemical Society · doi:10.1021/ja960582d · Cited by 6,210
To What Extent Can Aromaticity Be Defined Uniquely?
Cyrañski, M. K., Krygowski, T. M., Katritzky, A. R., & Schleyer, P. V. R. (2002) · The Journal of Organic Chemistry · doi:10.1021/jo016255s · Cited by 727
Poater, J., Fradera, X., Duran, M., & Solà, M. (2003) · Chemistry – A European Journal · doi:10.1002/chem.200390041 · Cited by 449
Cited by
Nucleus-Independent Chemical Shifts (NICS) as an Aromaticity Criterion
Chen, Z., Wannere, C. S., Corminboeuf, C., Puchta, R., & Schleyer, P. V. R. (2005) · Chemical Reviews · doi:10.1021/cr030088+ · Cited by 3,847
Poater, J., Duran, M., Solà, M., & Silvi, B. (2005) · Chemical Reviews · doi:10.1021/cr030085x · Cited by 803
All-Metal Aromaticity and Antiaromaticity
Boldyrev, A. I., & Wang, L.-S. (2005) · Chemical Reviews · doi:10.1021/cr030091t · Cited by 608
The aromatic fluctuation index (FLU): A new aromaticity index based on electron delocalization
Matito, E., Duran, M., & Solà, M. (2005) · The Journal of Chemical Physics · doi:10.1063/1.1824895 · Cited by 516
Lu, T., & Chen, Q. (2020) · Theoretical Chemistry Accounts · doi:10.1007/s00214-019-2541-z · Cited by 466
Metadata
- Authors
- Santos, J. C., Tiznado, W., Contreras, R., & Fuentealba, P.
- Venue
- The Journal of Chemical Physics
- Publisher
- AIP Publishing
- Published
- 2004-01-22
- Volume
- 120
- Issue
- 4
- Pages
- 1670-1673
- ISSN
- 0021-9606 (ISSN-L)
- 1089-7690
- OpenAlex
- W1976495225
- Cited by
- 256
- References
- 3
- FWCI
- 7.84
- Type
- journal article
- Language
- en
- Open access
- green
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