Rhodium-Catalyzed Hydroformylation of Ketal-Masked β-Isophorone: Computational Explanation for the Unexpected Reaction Evolution of the Tertiary Rh-Alkyl via an Exocyclic β-Elimination Derivative-Reference-Cited by-同舟云学术

Rhodium-Catalyzed Hydroformylation of Ketal-Masked β-Isophorone: Computational Explanation for the Unexpected Reaction Evolution of the Tertiary Rh-Alkyl via an Exocyclic β-Elimination Derivative

Published:2014-12-04 Issue:21 Volume:119 Page:5117-5133
ISSN:1089-5639
Container-title:The Journal of Physical Chemistry A
language:en
Short-container-title:J. Phys. Chem. A

Author:

Alagona Giuliano¹,Ghio Caterina¹

Affiliation:

1. CNR-IPCF, Institute for the Chemical and Physical Processes, Pisa UOS, Molecular Modeling Lab, Via Moruzzi 1, I-56124 Pisa, Italy

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/jp508294z

Reference65 articles.

1. Rhodium catalyzed hydroformylation of β-isophorone: An unexpected result

2. Catalysis by gold. Alkyl isomerization, cis-trans rearrangement, and reductive elimination of alkylgold(III) complexes

3. Alkyl group isomerization studies with unusually stable alkylmetal complexes of palladium and platinum. Secondary-primary alkyl isomerization equilibria in the absence of steric influences from ancillary ligands

4. Synthesis of extremely stable alkylpalladium complexes of the type (Me2NCS2)Pd(PEt3)(alkyl). Crystal and molecular structures of the isomers [cyclic] (CH2CH2CH2CH2NCS2)Pd(PEt3)(n-propyl) and [cyclic] (CH2CH2CH2CH2NCS2)Pd(PEt3)(isopropyl)

5. Isomerization of the alkyl ligand in (Me2NCS2)Pd(PR3)(alkyl) complexes. Influences of heteroatom substituents in the alkyl group on the alkyl isomerization equilibria and stability of alkylmetal complexes

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1. Using para hydrogen induced polarization to study steps in the hydroformylation reaction;Dalton Transactions;2019

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3. Theoretical Studies on the Mechanisms of Transfer Hydroformylation Between Hydrocinnamaldehyde and Norbornadiene Catalyzed by Rh(Xantphos) L Complexes;CHEM J CHINESE U;2016

4. Mechanism of Rhodium-Catalyzed Formyl Activation: A Computational Study;The Journal of Organic Chemistry;2016-03-08