Bulletin of the Korean Chemical Society

Korean Chemical Society (대한화학회)
권호 표지
DOI QR코드

DOI QR Code

Density Functional Theoretical Study on the N-H Bond Activation by Ir Pincer Complexes

  • Cho, Hyun (Department of Nanomechatronics Engineering, Pusan National University) ;
  • Woo, Han-Young (Department of Cogno-Mechatronics Engineering, Pusan National University) ;
  • Hwang, Sun-Gu (Department of Nanomedical Engineering, Pusan National University)
  • Received : 2010.02.14
  • Accepted : 2010.03.15
  • Published : 2010.05.20
Download PDF
⟨ Previous Next ⟩

Abstract

Keywords

References

  1. Morgan, E.; MacLean, D. F.; McDonald, R.; Turculet, L. J. Am. Chem. Soc. 2009, 131, 14234. https://doi.org/10.1021/ja906646v
  2. Zhao, J.; Goldman, A. S.; Hartwig, J. F. Science 2005, 307, 1080. https://doi.org/10.1126/science.1109389
  3. nzelberger, M.; Zhang, X.; Emge, T. J.; Goldman, A. S.; Zhao, J.; Incarvito, C.; Hartwig, J. F. J. Am. Chem. Soc. 2003, 125, 13644. https://doi.org/10.1021/ja037363u
  4. MacLean, D. F.; McDonald, R.; Ferguson, M. J.; Caddell, A. J.; Turculet, L. Chem. Comm. 2008, 5148.
  5. Jaguar v5.5; Schrodinger Inc.: Portland, Oregon, 2003.
  6. Gonzalez, C.; Schlegel, H. B. J. Chem. Phys. 1989, 90, 2154. https://doi.org/10.1063/1.456010
  7. Gonzalez, C.; Schlegel, H. B. J. Phys. Chem. 1990, 94, 5523. https://doi.org/10.1021/j100377a021
  8. Marten, B.; Kim, K.; Cortis, C.; Friesner, R. A.; Murphy, R. B.; Ringnalda, M. N.; Sitkoff, D.; Honig, B. J. Phys. Chem. 1996, 100, 11775. https://doi.org/10.1021/jp953087x
  9. Tannor, D. J.; Marten, B.; Murphy, R.; Friesner, R. A.; Sitkoff, D.; Nicholls, A.; Ringnalda, M. N.; Goddard, W. A., III.; Honig, B. J. Am. Chem. Soc. 1994, 116, 11875. https://doi.org/10.1021/ja00105a030

Cited by

  1. Calculation of Deuteration Exchange Reaction Pathway between Pincer-type Amido Hydride Ir(III) Complex and Deuterated Ammonia vol.38, pp.6, 2017, https://doi.org/10.1002/bkcs.11137
  2. Density Functional Theoretical Study on the Oxidative Additions of Silyl Halides to the Rh Pincer Complex vol.32, pp.7, 2011, https://doi.org/10.5012/bkcs.2011.32.7.2479
  3. Density Functional Theoretical Study on the Carbon-Halide Oxidative Additions to a Rh Pincer Complex vol.33, pp.3, 2010, https://doi.org/10.5012/bkcs.2012.33.3.1052
  4. Density Functional Theoretical Study on the Substituent Effect in Aryl Halide Oxidative Additions to a Rh Pincer Complex vol.33, pp.11, 2010, https://doi.org/10.5012/bkcs.2012.33.11.3838
  5. Rhodium catalyzed hydroamination of C2H4 with NH3 with pincer derived PE(CH2CH2X)P ligands - Fighting the energy span vol.748, pp.None, 2010, https://doi.org/10.1016/j.jorganchem.2013.03.004