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2 article(s) from Solà, Miquel

Unveiling the regioselectivity of rhodium(I)-catalyzed [2 + 2 + 2] cycloaddition reactions for open-cage C₇₀ production

Cristina Castanyer,
Anna Pla-Quintana,
Anna Roglans,
Albert Artigas and
Miquel Solà

Beilstein J. Org. Chem. 2024, 20, 272–279, doi:10.3762/bjoc.20.28

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Scheme 1: Rhodium(I)-catalyzed cycloaddition of C₆₀ with diynes to afford bis(fulleroid) derivatives [33].

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Figure 1: Types of [6,6]-bonds together with the [5,6]-bond of C₆₀ with their C–C distances in pristine C₆₀ a...

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Scheme 2: Rhodium-catalyzed cycloaddition of C₇₀ with diynes 1a and 1b.

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Figure 2: ¹H NMR (CS₂/CDCl₃, 400 MHz) spectrum of compound 2a as a mixture of two isomers.

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Figure 3: B3LYP-D3/cc-pVTZ-PP(SMD=o-DCB)//B3LYP-D3/CC-pVDZ-PP Gibbs energy profile of the [2 + 2 + 2] cycload...

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Scheme 3: Oxidative cleavage of bis(fulleroid) derivatives 2a and 2b.

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Figure 4: ¹H NMR (CS₂/CDCl₃, 400 MHz) spectrum of compound 3a as a mixture of three isomers. X = residual tol...

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Published 13 Feb 2024

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Complete σ* intramolecular aromatic hydroxylation mechanism through O₂ activation by a Schiff base macrocyclic dicopper(I) complex

Albert Poater and
Miquel Solà

Beilstein J. Org. Chem. 2013, 9, 585–593, doi:10.3762/bjoc.9.63

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Figure 1: Stationary points located along the reaction path of the aromatic hydroxylation mechanism (some H a...

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Figure 2: Computed structures of the potential equilibrium between the peroxo and bis-μ-oxo intermediates (so...

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Figure 3: Computed structures for a potential alternative pathway f→g of the σ* mechanism (some H atoms omitt...

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Figure 4: Computed structures for a potential alternative pathway e→g of the σ* mechanism (some H atoms omitt...

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Figure 5: Computed structures for a potential alternative pathway j→i of the σ* mechanism (Gibbs energies in ...

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Figure 6: Computed structures for a potential alternative pathway b→g of the σ* mechanism (some H atoms omitt...

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Figure 7: Computed structures for a potential alternative pathway c→g of the σ* mechanism (some H atoms omitt...

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Published 20 Mar 2013

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Unveiling the regioselectivity of rhodium(I)-catalyzed [2 + 2 + 2] cycloaddition reactions for open-cage C70 production

Complete σ* intramolecular aromatic hydroxylation mechanism through O2 activation by a Schiff base macrocyclic dicopper(I) complex

Unveiling the regioselectivity of rhodium(I)-catalyzed [2 + 2 + 2] cycloaddition reactions for open-cage C₇₀ production

Complete σ* intramolecular aromatic hydroxylation mechanism through O₂ activation by a Schiff base macrocyclic dicopper(I) complex