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Theoretical study of cyclohexane hydroxylation by three possible isomers of [FeIV(O)(R-TPEN)]2+: does the pentadentate ligand wrapping around the metal center differently lead to the different stability and reactivity?

Authors
  1. A Bassan
  2. A Decker
  3. A Decker
  4. A Decker
  5. A Decker
  6. A Decker
  7. AD Becke
  8. AD Becke
  9. AD Becke
  10. AJ Johansson
  11. AP Scott
  12. AR Groenhof
  13. C Krebs
  14. C Lee
  15. CV Sastri
  16. CV Sastri
  17. CV Sastri
  18. D Kumar
  19. D Quinonero
  20. D SchrÖder
  21. DA Proshlyakov
  22. DP Galonic
  23. EA Carter
  24. EI Solomon
  25. EJ Klinker
  26. F Neese
  27. G Schenk
  28. H Hirao
  29. H Hirao
  30. H Hirao
  31. H Hirao
  32. J Baker
  33. J Kaizer
  34. J Mola
  35. J-U Rohde
  36. J-U Rohde
  37. J-U Rohde
  38. JC Nesheim
  39. JC Price
  40. JC Price
  41. JP Hay
  42. JP Perdew
  43. JP Perdew
  44. Keli Han
  45. L Que Jr
  46. L Que Jr
  47. LM Hoffart
  48. M Costas
  49. M Martinho
  50. M Swart
  51. M You
  52. MH Lim
  53. MJ Park
  54. ML Neidig
  55. MR Bukowski
  56. MYM Pau
  57. NC Handy
  58. NY Oh
  59. RA Friesner
  60. S Kumar
  61. S Shaik
  62. S Shaik
  63. SO Kim
  64. SP Visser de
  65. SP Visser de
  66. SP Visser de
  67. SP Visser de
  68. TK Paine
  69. V Balland
  70. W Nam
  71. XP Shan
  72. Yi Wang
  73. Yong Wang
Publication date
Publisher
'Springer Science and Business Media LLC'
Doi

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      Last time updated on 11/12/2019

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