Evidence map›Paper›PMID 42298148›Full record

ArticleScientific reports2026

Schleyer hyperconjugative aromaticity as an efficient strategy to induce more delocalization in penguinone and thiopenguinone derivatives: a DFT investigation.

Erfan Shafipour, Zohreh Mirjafary, Hamid Saeidian

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Article in Scientific reports, 2026. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Not yet cited in PubMed.

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1 · What the graph read from it

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2 · The registry

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3 · Its place in the literature

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4 · The record

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5 · Who and what money

Authors and funding

3 authors.

Erfan ShafipourDepartment of Chemistry, SR.C, Islamic Azad University, Tehran, Iran.
Zohreh MirjafaryDepartment of Chemistry, SR.C, Islamic Azad University, Tehran, Iran. zmirjafary@srbiau.ac.ir.
Hamid SaeidianDepartment of Science, Payame Noor University (PNU), PO Box: 19395- 4697, Tehran, Iran.

Funding

No grant is acknowledged in the PubMed record.

6 · The paper itself

Abstract

In this study, the impact of Schleyer hyperconjugative aromaticity on penguinone and thiopenguinone derivatives was systematically investigated using DFT at the B3LYP/6-311 + G(d, p) level. Structural, electronic, and magnetic aromaticity indices were computed to evaluate the delocalization character of the designed systems. The results reveal that bulky electron-donating substituents such as -GeMe

Indexed as

Density functional theoryElectron delocalizationPenguinoneSchleyer hyperconjugative aromaticityThiopenguinone

Identifiers

PMID42298148
PMCPMC13530126

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Read under generation 80e0d062 · epoch 390. Bibliography from PubMed, PubMed Central and OpenAlex; grants from NIH RePORTER; trial links from ClinicalTrials.gov; estimates, votes and beliefs from the OpenQuestion graph.