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Items: 1 to 20 of 44

1.

Toward Fully Unsupervised Anharmonic Computations Complementing Experiment for Robust and Reliable Assignment and Interpretation of IR and VCD Spectra from Mid-IR to NIR. The Case of 2,3-Butanediol and Trans-1,2-Cyclohexanediol.

Paoloni L, Mazzeo G, Longhi G, Abbate S, Fusè M, Bloino J, Barone V.

J Phys Chem A. 2020 Jan 10. doi: 10.1021/acs.jpca.9b11025. [Epub ahead of print]

PMID:
31922423
2.

Unbiased Determination of Absolute Configurations by vis-à-vis Comparison of Experimental and Simulated Spectra: The Challenging Case of Diplopyrone.

Fusè M, Mazzeo G, Longhi G, Abbate S, Masi M, Evidente A, Puzzarini C, Barone V.

J Phys Chem B. 2019 Oct 31;123(43):9230-9237. doi: 10.1021/acs.jpcb.9b08375. Epub 2019 Oct 18.

PMID:
31580674
3.

Optically active Ag(i): o-OPE helicates using a single homochiral sulfoxide as chiral inducer.

Resa S, Reiné P, Álvarez de Cienfuegos L, Guisán-Ceinos S, Ribagorda M, Longhi G, Mazzeo G, Abbate S, Mota AJ, Miguel D, Cuerva JM.

Org Biomol Chem. 2019 Sep 28;17(36):8425-8434. doi: 10.1039/c9ob01573f. Epub 2019 Aug 30.

PMID:
31469142
4.

Assignment Through Chiroptical Methods of The Absolute Configuration of Fungal Dihydropyranpyran-4-5-Diones Phytotoxins, Potential Herbicides for Buffelgrass (Cenchrus ciliaris) Biocontrol.

Santoro E, Mazzeo G, Marsico G, Masi M, Longhi G, Superchi S, Evidente A, Abbate S.

Molecules. 2019 Aug 21;24(17). pii: E3022. doi: 10.3390/molecules24173022.

5.

Ferrocenes with simple chiral substituents: an in-depth theoretical and experimental VCD and ECD study.

Patti A, Pedotti S, Mazzeo G, Longhi G, Abbate S, Paoloni L, Bloino J, Rampino S, Barone V.

Phys Chem Chem Phys. 2019 May 8;21(18):9419-9432. doi: 10.1039/c9cp00437h.

PMID:
30997909
6.

Highly enantioselective "inherently chiral" electroactive materials based on a 2,2'-biindole atropisomeric scaffold.

Arnaboldi S, Benincori T, Penoni A, Vaghi L, Cirilli R, Abbate S, Longhi G, Mazzeo G, Grecchi S, Panigati M, Mussini PR.

Chem Sci. 2019 Jan 5;10(9):2708-2717. doi: 10.1039/c8sc04862b. eCollection 2019 Mar 7.

7.

OFF/ON switching of circularly polarized luminescence by oxophilic interaction of homochiral sulfoxide-containing o-OPEs with metal cations.

Reiné P, Ortuño AM, Resa S, Álvarez de Cienfuegos L, Blanco V, Ruedas-Rama MJ, Mazzeo G, Abbate S, Lucotti A, Tommasini M, Guisán-Ceinos S, Ribagorda M, Campaña AG, Mota A, Longhi G, Miguel D, Cuerva JM.

Chem Commun (Camb). 2018 Dec 11;54(99):13985-13988. doi: 10.1039/c8cc08395a.

PMID:
30480686
8.

Mannich-type addition of 1,3-dicarbonyl compounds to chiral tert-butanesulfinyltrifluoroacetaldimines. Mechanistic aspects and chiroptical studies.

Mazzeo G, Longhi G, Abbate S, Mangiavacchi F, Santi C, Han J, Soloshonok VA, Melensi L, Ruzziconi R.

Org Biomol Chem. 2018 Nov 21;16(45):8742-8750. doi: 10.1039/c8ob02204f.

PMID:
30393798
9.

Absolute configuration assignment to anticancer Amaryllidaceae alkaloid jonquailine.

Vergura S, Santoro E, Masi M, Evidente A, Scafato P, Superchi S, Mazzeo G, Longhi G, Abbate S.

Fitoterapia. 2018 Sep;129:78-84. doi: 10.1016/j.fitote.2018.06.013. Epub 2018 Jun 19.

PMID:
29928968
10.

Searching for Models Exhibiting High Circularly Polarized Luminescence: Electroactive Inherently Chiral Oligothiophenes.

Benincori T, Appoloni G, Mussini PR, Arnaboldi S, Cirilli R, Quartapelle Procopio E, Panigati M, Abbate S, Mazzeo G, Longhi G.

Chemistry. 2018 Aug 1;24(43):11082-11093. doi: 10.1002/chem.201801158. Epub 2018 Jul 2.

PMID:
29719070
11.

Toward a general mixed quantum/classical method for the calculation of the vibronic ECD of a flexible dye molecule with different stable conformers: Revisiting the case of 2,2,2-trifluoro-anthrylethanol.

Cerezo J, Aranda D, Avila Ferrer FJ, Prampolini G, Mazzeo G, Longhi G, Abbate S, Santoro F.

Chirality. 2018 Jun;30(6):730-743. doi: 10.1002/chir.22853. Epub 2018 Apr 16.

PMID:
29660182
12.

Asymmetric Synthesis of Spirooxindoles via Nucleophilic Epoxidation Promoted by Bifunctional Organocatalysts.

Miceli M, Mazziotta A, Palumbo C, Roma E, Tosi E, Longhi G, Abbate S, Lupattelli P, Mazzeo G, Gasperi T.

Molecules. 2018 Feb 16;23(2). pii: E438. doi: 10.3390/molecules23020438.

13.

Sulfoxide-Induced Homochiral Folding of ortho-Phenylene Ethynylenes (o-OPEs) by Silver(I) Templating: Structure and Chiroptical Properties.

Resa S, Miguel D, Guisán-Ceinos S, Mazzeo G, Choquesillo-Lazarte D, Abbate S, Crovetto L, Cárdenas DJ, Carreño MC, Ribagorda M, Longhi G, Mota AJ, Álvarez de Cienfuegos L, Cuerva JM.

Chemistry. 2018 Feb 21;24(11):2653-2662. doi: 10.1002/chem.201704897. Epub 2018 Jan 24.

PMID:
29240981
14.

Exploring potentialities and limitations of stapled o-oligo(phenyleneethynylene)s (o-OPEs) as efficient circularly polarized luminescence emitters.

Reiné P, Justicia J, Morcillo SP, Mazzeo G, García-Fernández E, Rodríguez-Diéguez A, Álvarez de Cienfuegos L, Abbate S, Cuerva JM, Longhi G, Miguel D.

Chirality. 2018 Jan;30(1):43-54. doi: 10.1002/chir.22774. Epub 2017 Oct 31.

PMID:
29086443
15.

On the aggregation of bilirubinoids in solution as evidenced by VCD and ECD spectroscopy and DFT calculations.

Ghidinelli S, Longhi G, Mazzeo G, Abbate S, Boiadjiev SE, Lightner DA.

Chirality. 2018 Jan;30(1):19-28. doi: 10.1002/chir.22776. Epub 2017 Oct 30.

PMID:
29083054
16.

Importance and Difficulties in the Use of Chiroptical Methods to Assign the Absolute Configuration of Natural Products: The Case of Phytotoxic Pyrones and Furanones Produced by Diplodia corticola.

Mazzeo G, Cimmino A, Masi M, Longhi G, Maddau L, Memo M, Evidente A, Abbate S.

J Nat Prod. 2017 Sep 22;80(9):2406-2415. doi: 10.1021/acs.jnatprod.7b00119. Epub 2017 Sep 13.

PMID:
28901768
17.

Synthesis of Intrinsically Blue-Colored bis-Nitronyl Nitroxide Peptidomimetic Templates and Their Conformational Preferences as Revealed by a Combined Spectroscopic Analysis.

De Zotti M, Wright K, d'Aboville E, Toffoletti A, Toniolo C, Longhi G, Mazzeo G, Abbate S, Formaggio F.

J Org Chem. 2017 Oct 6;82(19):10033-10042. doi: 10.1021/acs.joc.7b01498. Epub 2017 Sep 18.

PMID:
28858505
18.

Solvent-free, uncatalyzed asymmetric "ene" reactions of N-tert-butylsulfinyl-3,3,3-trifluoroacetaldimines: a general approach to enantiomerically pure α-(trifluoromethyl)tryptamines.

Mazzeo G, Longhi G, Abbate S, Palomba M, Bagnoli L, Marini F, Santi C, Han J, Soloshonok VA, Di Crescenzo E, Ruzziconi R.

Org Biomol Chem. 2017 May 10;15(18):3930-3937. doi: 10.1039/c7ob00670e.

PMID:
28436530
19.

(R)-(-)-Aloesaponol III 8-Methyl Ether from Eremurus persicus: A Novel Compound against Leishmaniosis.

Rossi D, Ahmed KM, Gaggeri R, Della Volpe S, Maggi L, Mazzeo G, Longhi G, Abbate S, Corana F, Martino E, Machado M, Varandas R, Sousa MD, Collina S.

Molecules. 2017 Mar 24;22(4). pii: E519. doi: 10.3390/molecules22040519.

20.

The role of chirality in a set of key intermediates of pharmaceutical interest, 3-aryl-substituted-γ-butyrolactones, evidenced by chiral HPLC separation and by chiroptical spectroscopies.

Rossi D, Nasti R, Collina S, Mazzeo G, Ghidinelli S, Longhi G, Memo M, Abbate S.

J Pharm Biomed Anal. 2017 Sep 10;144:41-51. doi: 10.1016/j.jpba.2017.01.007. Epub 2017 Jan 5.

PMID:
28118957

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