Guegan F - Search Results

1

An Open-Shell Functionalization of Inorganic Benzene.

Grenda S, Claiser N, Barbon A, Guégan F, Toury B, Luneau D. Grenda S, et al. Among authors: guegan f. J Am Chem Soc. 2024 Dec 4;146(48):32906-32911. doi: 10.1021/jacs.4c10736. Epub 2024 Nov 20. J Am Chem Soc. 2024. PMID: 39566893

2

Leveraging long-lived arenium ions in superacid for meta-selective methylation.

Bourbon P, Vitse K, Martin-Mingot A, Geindre H, Guégan F, Michelet B, Thibaudeau S. Bourbon P, et al. Among authors: guegan f. Nat Commun. 2024 Aug 28;15(1):7435. doi: 10.1038/s41467-024-49421-8. Nat Commun. 2024. PMID: 39198397 Free PMC article.

3

Charge transfer interaction revisited by a Fermi-Dirac derived approach.

Gayraud O, Guégan F. Gayraud O, et al. Among authors: guegan f. J Mol Model. 2024 Aug 13;30(9):307. doi: 10.1007/s00894-024-06097-7. J Mol Model. 2024. PMID: 39136856

4

Automated exploration of the conformational degrees of freedom along reaction profiles - driving a FASTCAR.

Gayraud O, Courbière B, Guégan F. Gayraud O, et al. Among authors: guegan f. Phys Chem Chem Phys. 2024 Oct 17;26(40):25780-25787. doi: 10.1039/d4cp01721h. Phys Chem Chem Phys. 2024. PMID: 39101325

5

Trans-Concerted Addition to Alkynes: the case of Ynamide Silylzincation.

Guégan F, Chemla F, Ferreira F, Gérard H, Perez-Luna A, Halbert S. Guégan F, et al. Chemistry. 2024 Aug 1;30(43):e202401751. doi: 10.1002/chem.202401751. Epub 2024 Jul 11. Chemistry. 2024. PMID: 38808477

6

Rational design of 2D Janus P3m1 M₂N₃ (M = Cu, Zr, and Hf) and their surface-functionalized derivatives: ferromagnetic, piezoelectric, and photocatalytic properties.

Zhang H, Guégan F, Wang J, Frapper G. Zhang H, et al. Among authors: guegan f. Phys Chem Chem Phys. 2024 May 22;26(20):14675-14683. doi: 10.1039/d4cp00544a. Phys Chem Chem Phys. 2024. PMID: 38716510

7

Determination of the Hammett Acidity of HF/Base Reagents.

Longuet M, Vitse K, Martin-Mingot A, Michelet B, Guégan F, Thibaudeau S. Longuet M, et al. Among authors: guegan f. J Am Chem Soc. 2024 May 1;146(17):12167-12173. doi: 10.1021/jacs.4c02344. Epub 2024 Apr 16. J Am Chem Soc. 2024. PMID: 38626381 Free article.

8

Predicted High-Energy Density MN₈ Containing Anionic 18-Crown-6 Ring-Based Polynitrogen Monolayers Acting as Cryptand.

Pitié S, Wang B, Guégan F, Frapper G. Pitié S, et al. Among authors: guegan f. Inorg Chem. 2024 Apr 22;63(16):7293-7302. doi: 10.1021/acs.inorgchem.4c00173. Epub 2024 Apr 11. Inorg Chem. 2024. PMID: 38605465

9

Accumulation, Characterization and Reactivity of Chiral Ammonium-Carboxonium Dications in Superacid.

Berrino E, Cantin T, Artault M, Beck S, Jessen C, Marrot J, Guégan F, Mingot A, Kornath A, Thibaudeau S. Berrino E, et al. Among authors: guegan f. Angew Chem Int Ed Engl. 2024 Jun 3;63(23):e202404066. doi: 10.1002/anie.202404066. Epub 2024 Apr 25. Angew Chem Int Ed Engl. 2024. PMID: 38587216

10

Expanding horizons in conceptual density functional theory: Novel ensembles and descriptors to decipher reactivity patterns.

Hoffmann G, Guégan F, Labet V, Joubert L, Chermette H, Morell C, Tognetti V. Hoffmann G, et al. Among authors: guegan f. J Comput Chem. 2024 Jul 30;45(20):1716-1726. doi: 10.1002/jcc.27363. Epub 2024 Apr 5. J Comput Chem. 2024. PMID: 38580454

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