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Commun 51:4488–4491
48. Jiang J, Ramozzi R, Moteki S, Usui A, Maruoka K, Morokuma K (2015) J Org Chem
80:9264–9271
49. Funes-Ardoiz I, Sameera WMC, Romero RM, Martínez C, Souto JA, Sampedro D, Muñiz K,
Maseras F (2016) Chem A Eur J 22:7545–7553
50. Sreenithya A, Patel C, Hadad CM, Sunoj RB (2017) ACS Catal 7:4189–4196
51. Pluta R, Krach PE, Cavallo L, Falivene L, Rueping M (2018) ACS Catal 8:2582–2588
52. Zhou B, Haj MK, Jacobsen EN, Houk KN, Xue X-S (2018) J Am Chem Soc 140:15206–15218
53. Shu S, Li Y, Jiang J, Ke Z, Liu Y (2019) J Org Chem 84:458–462
54. Zhou B, Yan T, Xue X-S, Cheng J-P (2016) Org Lett 18:6128–6131
55. Zhou B, Xue X-S, Cheng J-P (2017) Tetrahedron Lett 58:1287–1291
56. Yan T, Zhou B, Xue X-S, Cheng J-P (2016) J Org Chem 81:9006–9011
57. Andries-Ulmer A, Brunner C, Rehbein J, Gulder T (2018) J Am Chem Soc 140:13034–13041
58. Sala O, Lüthi HP, Togni A (2014) J Comput Chem 35:2122–2131
59. Ling L, Liu K, Li X, Li Y (2015) ACS Catal 5:2458–2468
60. Sala O, Lüthi HP, Togni A, Iannuzzi M, Hutter J (2015) J Comput Chem 36:785–794
61. Sala O, Santschi N, Jungen S, Lüthi HP, Iannuzzi M, Hauser N, Togni A (2016) Chem A Eur J
22:1704–1713
62. Sun T-Y, Wang X, Geng H, Xie Y, Wu Y-D, Zhang X, Schaefer III HF (2016) Chem Commun
52:5371–5374
63. Pinto de Magalhaes H, Luthi HP, Bultinck P (2016) Phys Chem Chem Phys 18:846–856
64. Pinto de Magalhães H, Togni A, Lüthi HP (2017) J Org Chem 82:11799–11805
65. Sameera WMC, Maseras F (2012) WIREs Comput Mol Sci 2:375–385
66. Sperger T, Sanhueza IA, Kalvet I, Schoenebeck F (2015) Chem Rev 115:9532–9586
67. Lam Y-H, Grayson MN, Holland MC, Simon A, Houk KN (2016) Acc Chem Res 49:750–762
68. Santoro S, Kalek M, Huang G, Himo F (2016) Acc Chem Res 49:1006–1018
69. Balcells D, Clot E, Eisenstein O, Nova A, Perrin L (2016) Acc Chem Res 49:1070–1078
70. Sunoj RB (2016) Acc Chem Res 49:1019–1028
71. Peng Q, Paton RS (2016) Acc Chem Res 49:1042–1051
72. Lee C, Yang W, Parr RG (1988) Phys Rev B 37:785–789
73. Becke AD (1993) J Chem Phys 98:5648–5652
74. Barone V, Cossi M (1998) J Phys Chem A 102:1995–2001
75. Cossi M, Rega N, Scalmani G, Barone V (2003) J Comput Chem 24:669–681
76. Marenich AV, Cramer CJ, Truhlar DG (2009) J Phys Chem B 113:6378–6396
77. Grimme S, Antony J, Ehrlich S, Krieg H (2010) J Chem Phys 132:154104–154122
78. Grimme S, Ehrlich S, Goerigk L (2011) J Comput Chem 32:1456–1465
79. Zhang J, Szabó KJ, Himo F (2017) ACS Catal 7:1093–1100
80. Kalek M, Himo F (2017) J Am Chem Soc 139:10250–10266
81. Mai BK, Szabó KJ, Himo F (2018) ACS Catal 8:4483–4492
82. Jobin-Des Lauriers A, Legault YC (2015) Molecules 20:22635–22644
83. Izquierdo S, Essafi S, del Rosal I, Vidossich P, Pleixats R, Vallribera A, Ujaque G, Lledós A,
Shafir A (2016) J Am Chem Soc 138:12747–12750
84. Janson PG, Ghoneim I, Ilchenko NO, Szabó KJ (2012) Org Lett 14:2882–2885
85. Guo X, Hu W (2013) Acc Chem Res 46:2427–2440
86. Xia Y, Qiu D, Wang J (2017) Chem Rev 117:13810–13889
87. Werlé C, Goddard R, Philipps P, Farès C, Fürstner A (2016) J Am Chem Soc 138:3797–3805
88. Wong FM, Wang J, Hengge AC, Wu W (2007) Org Lett 9:1663–1665
89. Liang Y, Zhou H, Yu Z-X (2009) J Am Chem Soc 131:17783–17785
Mechanisms of Metal-Catalyzed Electrophilic F/CF 3 /SCF 3 Transfer Reactions. . .
55
136:16563–16573
46. Beaulieu S, Legault CY (2015) Chem A Eur J 21:11206–11211
47. Tolnai GL, Szekely A, Mako Z, Gati T, Daru J, Bihari T, Stirling A, Novak Z (2015) Chem
Commun 51:4488–4491
48. Jiang J, Ramozzi R, Moteki S, Usui A, Maruoka K, Morokuma K (2015) J Org Chem
80:9264–9271
49. Funes-Ardoiz I, Sameera WMC, Romero RM, Martínez C, Souto JA, Sampedro D, Muñiz K,
Maseras F (2016) Chem A Eur J 22:7545–7553
50. Sreenithya A, Patel C, Hadad CM, Sunoj RB (2017) ACS Catal 7:4189–4196
51. Pluta R, Krach PE, Cavallo L, Falivene L, Rueping M (2018) ACS Catal 8:2582–2588
52. Zhou B, Haj MK, Jacobsen EN, Houk KN, Xue X-S (2018) J Am Chem Soc 140:15206–15218
53. Shu S, Li Y, Jiang J, Ke Z, Liu Y (2019) J Org Chem 84:458–462
54. Zhou B, Yan T, Xue X-S, Cheng J-P (2016) Org Lett 18:6128–6131
55. Zhou B, Xue X-S, Cheng J-P (2017) Tetrahedron Lett 58:1287–1291
56. Yan T, Zhou B, Xue X-S, Cheng J-P (2016) J Org Chem 81:9006–9011
57. Andries-Ulmer A, Brunner C, Rehbein J, Gulder T (2018) J Am Chem Soc 140:13034–13041
58. Sala O, Lüthi HP, Togni A (2014) J Comput Chem 35:2122–2131
59. Ling L, Liu K, Li X, Li Y (2015) ACS Catal 5:2458–2468
60. Sala O, Lüthi HP, Togni A, Iannuzzi M, Hutter J (2015) J Comput Chem 36:785–794
61. Sala O, Santschi N, Jungen S, Lüthi HP, Iannuzzi M, Hauser N, Togni A (2016) Chem A Eur J
22:1704–1713
62. Sun T-Y, Wang X, Geng H, Xie Y, Wu Y-D, Zhang X, Schaefer III HF (2016) Chem Commun
52:5371–5374
63. Pinto de Magalhaes H, Luthi HP, Bultinck P (2016) Phys Chem Chem Phys 18:846–856
64. Pinto de Magalhães H, Togni A, Lüthi HP (2017) J Org Chem 82:11799–11805
65. Sameera WMC, Maseras F (2012) WIREs Comput Mol Sci 2:375–385
66. Sperger T, Sanhueza IA, Kalvet I, Schoenebeck F (2015) Chem Rev 115:9532–9586
67. Lam Y-H, Grayson MN, Holland MC, Simon A, Houk KN (2016) Acc Chem Res 49:750–762
68. Santoro S, Kalek M, Huang G, Himo F (2016) Acc Chem Res 49:1006–1018
69. Balcells D, Clot E, Eisenstein O, Nova A, Perrin L (2016) Acc Chem Res 49:1070–1078
70. Sunoj RB (2016) Acc Chem Res 49:1019–1028
71. Peng Q, Paton RS (2016) Acc Chem Res 49:1042–1051
72. Lee C, Yang W, Parr RG (1988) Phys Rev B 37:785–789
73. Becke AD (1993) J Chem Phys 98:5648–5652
74. Barone V, Cossi M (1998) J Phys Chem A 102:1995–2001
75. Cossi M, Rega N, Scalmani G, Barone V (2003) J Comput Chem 24:669–681
76. Marenich AV, Cramer CJ, Truhlar DG (2009) J Phys Chem B 113:6378–6396
77. Grimme S, Antony J, Ehrlich S, Krieg H (2010) J Chem Phys 132:154104–154122
78. Grimme S, Ehrlich S, Goerigk L (2011) J Comput Chem 32:1456–1465
79. Zhang J, Szabó KJ, Himo F (2017) ACS Catal 7:1093–1100
80. Kalek M, Himo F (2017) J Am Chem Soc 139:10250–10266
81. Mai BK, Szabó KJ, Himo F (2018) ACS Catal 8:4483–4492
82. Jobin-Des Lauriers A, Legault YC (2015) Molecules 20:22635–22644
83. Izquierdo S, Essafi S, del Rosal I, Vidossich P, Pleixats R, Vallribera A, Ujaque G, Lledós A,
Shafir A (2016) J Am Chem Soc 138:12747–12750
84. Janson PG, Ghoneim I, Ilchenko NO, Szabó KJ (2012) Org Lett 14:2882–2885
85. Guo X, Hu W (2013) Acc Chem Res 46:2427–2440
86. Xia Y, Qiu D, Wang J (2017) Chem Rev 117:13810–13889
87. Werlé C, Goddard R, Philipps P, Farès C, Fürstner A (2016) J Am Chem Soc 138:3797–3805
88. Wong FM, Wang J, Hengge AC, Wu W (2007) Org Lett 9:1663–1665
89. Liang Y, Zhou H, Yu Z-X (2009) J Am Chem Soc 131:17783–17785
Mechanisms of Metal-Catalyzed Electrophilic F/CF 3 /SCF 3 Transfer Reactions. . .
55