Organopalladium Catalysis as a Proving Ground for Data-Rich Approaches to Reaction Development and Quantitative Predictions

ACS Catalysis, Journal Year: 2023, Volume and Issue: 13(24), P. 15691 - 15707

Published: Nov. 21, 2023

With the advent of high-throughput methods for both computation and experimentation, data-rich approaches to discovering understanding chemical reactions are becoming ever more central catalysis research. Organopalladium is at forefront these new approaches, providing a rich proving ground method development validation. This critical Perspective discusses number recent case studies from academic industrial laboratories that illustrate how generate, analyze, correlate large data sets quantitative predictions reactivity selectivity. Both power potential pitfalls discussed, as opportunities practical fundamental mechanistic insights.

Language: Английский

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Synthetic Advantages of Defluorinative C−F Bond Functionalization

Angewandte Chemie, Journal Year: 2023, Volume and Issue: 135(49)

Published: Aug. 22, 2023

Abstract Much progress has been made in the development of methods to both create compounds that contain C−F bonds and functionalize bonds. As such, are becoming common versatile synthetic functional handles. This review summarizes advantages defluorinative functionalization reactions for small molecule synthesis. The coverage is organized by type carbon framework fluorine attached mono‐ polyfluorinated motifs. main challenges, opportunities advances discussed each class organofluorine. Most text focuses on case studies illustrate how defluorofunctionalization can improve routes targets or properties enable unique mechanisms reactions. broader goal showcase incorporating exploiting design routes, improvement specific advent new methods.

Language: Английский

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Organopalladium Catalysis as a Proving Ground for Data-Rich Approaches to Reaction Development and Quantitative Predictions

Published: Aug. 16, 2023

With the advent of high-throughput methods for both computation and experimentation, data-rich approaches to discovering understanding chemical reactions are becoming ever more central catalysis research. Organopalladium is at forefront these new approaches, providing a rich proving ground method development validation. This critical Perspective discusses number recent case studies from academic industrial laboratories that illustrate how generate, analyze, correlate large data sets quantitative predictions reactivity selectivity. Both power potential pitfalls discussed, as opportunities practical fundamental mechanistic insights.

Language: Английский

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Organopalladium Catalysis as a Proving Ground for Data-Rich Approaches to Reaction Development and Quantitative Predictions

Published: Oct. 11, 2023

With the advent of high-throughput methods for both computation and experimentation, data-rich approaches to discovering understanding chemical reactions are becoming ever more central catalysis research. Organopalladium is at forefront these new approaches, providing a rich proving ground method development validation. This critical Perspective discusses number recent case studies from academic industrial laboratories that illustrate how generate, analyze, correlate large data sets quantitative predictions reactivity selectivity. Both power potential pitfalls discussed, as opportunities practical fundamental mechanistic insights.

Language: Английский

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