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Reply to the Correspondence on "How Aromatic Are Molecular Nanorings? The Case of a Six-Porphyrin Nanoring".
- Source :
-
Angewandte Chemie (International ed. in English) [Angew Chem Int Ed Engl] 2022 Sep 05; Vol. 61 (36), pp. e202206836. Date of Electronic Publication: 2022 Jul 11. - Publication Year :
- 2022
-
Abstract
- A recent article by Anderson and co-workers challenges our conclusions on the aromaticity of the four oxidation states of a butadyine-linked six-porphyrin nanoring, based on the experimental <superscript>1</superscript> H-NMR data and some recent calculations they have performed using the BLYP35 functional. Here, we show that BLYP35 should be taken with caution and demonstrate that the indirect evidence of a ring current from experimental <superscript>1</superscript> H-NMR data is not a definite proof of aromaticity.<br /> (© 2022 Wiley-VCH GmbH.)
Details
- Language :
- English
- ISSN :
- 1521-3773
- Volume :
- 61
- Issue :
- 36
- Database :
- MEDLINE
- Journal :
- Angewandte Chemie (International ed. in English)
- Publication Type :
- Editorial & Opinion
- Accession number :
- 35818692
- Full Text :
- https://doi.org/10.1002/anie.202206836