Can a pentamethylcyclopentadienyl ligand act as a proton-relay in f-element chemistry? Insights from a joint experimental/theoretical study

Author:

Kefalidis Christos E.12345,Perrin Lionel67895,Burns Carol J.101112,Berg David J.13141516,Maron Laurent12345,Andersen Richard A.13171812

Affiliation:

1. LPCNO

2. CNRS & INSA

3. Université Paul Sabatier

4. Toulouse 31077

5. France

6. Université Lyon 1

7. CNRS UMR 5246

8. Institut de Chimie et Biochimie Moléculaires et Supramoléculaires

9. F-69622 Villeurbanne

10. Los Alamos National Laboratory

11. Los Alamos

12. USA

13. Department of Chemistry

14. University of Victoria

15. Victoria

16. Canada V8W 3V6

17. University of California

18. Berkeley

Abstract

Isomerisation of buta-1,2-diene to but-2-yne by (Me5C5)2Yb is a thermodynamically favourable reaction, with the ΔrG° estimated from experimental data at 298 K to be −3.0 kcal mol−1.

Publisher

Royal Society of Chemistry (RSC)

Subject

Inorganic Chemistry

Reference99 articles.

1. J. Hartwig , Organotransition Metal Chemistry, University Science Books, Sausalito, CA, 2010

2. S. T. Liddle , The rare Earth Elements, Fundamentals and Applications, ed. D. A. Atwood, Wiley Publishing, 2012, p. 83

3. Ring-slippage chemistry of transition metal cyclopentadienyl and indenyl complexes

4. Methane exchange reactions of lanthanide and early-transition-metal methyl complexes

5. Quantum Chemical Characterization of Methane Metathesis in L2MCH3 (L = H, Cl, Cp, Cp*; M = Sc, Y, Lu)

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