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Vincent Gandon Institut de Chimie Moléculaire et des Matériaux d’Orsay, UMR 8182

Mécanismes réctionnels en catalyse homogène : Assistance de la chimie théorique. Les simulations numériques en chimie à Paris-sud 24 octobre 2012. Vincent Gandon Institut de Chimie Moléculaire et des Matériaux d’Orsay, UMR 8182 Université Paris-sud.

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Vincent Gandon Institut de Chimie Moléculaire et des Matériaux d’Orsay, UMR 8182

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  1. Mécanismes réctionnels en catalyse homogène : Assistance de la chimie théorique Les simulations numériques en chimie à Paris-sud 24 octobre 2012 Vincent Gandon Institut de Chimie Moléculaire et des Matériaux d’Orsay, UMR 8182 Université Paris-sud

  2. Asymmetric Carbocyclizations: Chiral Anion Strategy

  3. Asymmetric Carbocyclizations: Chiral Anion Strategy

  4. Asymmetric Carbocyclizations: Chiral Anion Strategy

  5. Asymmetric Carbocyclizations: Chiral Anion Strategy DFT, DG298 (kcal/mol) B3LYP/LANL2DZ/6-31G**

  6. Asymmetric Carbocyclizations: Chiral Anion Strategy Chem. Eur. J. 2011, 17, 13789

  7. Cyclization of Diynyl Esters

  8. Cyclization of Diynyl Esters DFT, DH298 (kcal/mol) B3LYP/LANL2DZ/6-31G** ACIE2011, 6868

  9. Cyclization of Diynyl Esters

  10. h1-Allene Gold Complexes OL2007, 2207

  11. Linear Triquinanes: Synthesis of D9(12)-Capnellene JACS 2009, 2993

  12. h1-Allene Gold Complexes

  13. h1-Allene Gold Complexes DFT, DH298 (kcal/mol) B3LYP/LANL2DZ/6-31G** AuBr3 + 0.0 1.4

  14. h1-Allene Gold Complexes DFT, DH298 (kcal/mol) B3LYP/LANL2DZ/6-31G** AuBr3 + 10.0 0.0

  15. Chirality Transfers ACIE2008, 7534

  16. exo-Cyclizations ACIE2006, 7596

  17. exo-Cyclizations Toste, Houk JACS 2008, 4517

  18. Polynuclear Gold Complexes

  19. Polynuclear Gold Complexes Mass spectroscopy (CAR)

  20. Intermediacy of Gold Acetylides?

  21. Intermediacy of Gold Acetylides?

  22. Intermediacy of Gold Acetylides? DFT, DG298 (kcal/mol) B3LYP/LANL2DZ/6-31G** Chem. Sci.2011, 2, 2417

  23. Facilities Paris 6 CRIHAN IDA ICSN

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