The catalytic dehydrogenation of ammonia-borane involving an unexpected hydrogen transfer to ligated carbene and subsequent carbon-hydrogen activation

Journal of the American Chemical Society

Volumn 130, Issue 6, 2008, Pages 1798-1799

  Yang, Xinzheng ^a   Hall, Michael B ^a  

^a TEXAS A AND M UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

2,2' BIS(1,3,4 TRIPHENYL 4,5 DIHYDRO 1H 1,2,4 TRIAZOL 5 YLIDENE)NICKEL; AMMONIA; BORANE DERIVATIVE; CARBENE; CARBON; HYDROGEN; NICKEL; UNCLASSIFIED DRUG;

ARTICLE; CATALYSIS; CATALYST; CHEMICAL STRUCTURE; DEHYDROGENATION; DENSITY FUNCTIONAL THEORY; ENTHALPY; PREDICTION; REACTION ANALYSIS; STRUCTURE ANALYSIS;

AMMONIA; BORANES; CATALYSIS; COMPUTER SIMULATION; HYDROCARBONS; HYDROGEN; HYDROGENATION; LIGANDS; METHANE; MODELS, CHEMICAL; NICKEL; ORGANOMETALLIC COMPOUNDS; QUANTUM THEORY;

EID: 39049097841     PISSN: 00027863     EISSN: None     Source Type: Journal    
DOI: 10.1021/ja0751328     Document Type: Article

References (24)

1. (a) Stephens, F. H.; Baker, R. T.; Matus, M. H.; Grant, D. J.; Dixon, D. A. Angew. Chem., Int. Ed. 2007, 46, 746.
2. (b) Li, J.; Kathmann, S. M.; Schenter, G. K.; Gutowski, M. J. Phys. Chem. C 2007, 118, 3292.
3. (c) Bluhm, M. E.; Bradley, M. G.; Butterick, R., III; Kusari, U.; Sneddon, L.
4. (d) G. J. Am. Chem. Soc. 2006, 128, 7748.
5. (e) Li, Q. S.; Zhuang, J.; Zhang, S. Chem. Phys. Lett. 2005, 404, 100.
6. (f) Morrison, C. A.; Siddick, M. M. Angew. Chem., Int. Ed. 2004, 43, 4780.
7. (g) Feaver, A.; Sepehri, S.; Shamberger, P.; Stowe, A.; Autrey, T.; Cao, G. J. Phys. Chem. B 2007, 111, 7469.
8. (h) Stowe, A. C.; Shaw, W. J.; Linehan, J. C.; Schmid, B.; Autrey, T. Phys. Chem. Chem. Phys. 2007, 9, 1831.
9. (i) Miranda, C. R.; Ceder, G. J. Chem. Phys. 2007, 126, 184703.
10. (j) Stephens, F. H.; Pons, V.; Baker, R. T. Dalton Trans. 2007, 2613.
11. (a) Denney, M. C.; Pons, V.; Hebden, T. J.; Heinekey, D. M.; Goldberg, K. I. J. Am. Chem. Soc. 2006, 128, 12048.
12. (b) Jaska, C. A.; Temple, K.; Lough, A. J.; Manners, I. J. Am. Chem. Soc. 2003, 125, 9424.
13. (c) Chen, Y.; Fulton, J. L.; Linehan, J. L.; Autrey, T. J. Am. Chem. Soc. 2005, 127, 3254.
14. (d) Clark, T. J.; Russell, C. A.; Manners, I. J. Am. Chem. Soc. 2006, 128, 9582.
15. (e) Xu, Q.; Chandra, M. J. Power Sources 2006, 163, 364.
16. Keaton, R. J.; Blacquiere, J. M.; Baker, R. T. J. Am. Chem. Soc. 2007, 129, 1844.
17. Paul, A.; Musgrave, C. B. Angew. Chem., Int. Ed. 2007, 46, 8153.
18. Luo, Y.; Ohno, K. Organometallics 2007, 26, 3597.
19. Frisch, M. J.; et al. Gaussian 03, revision C.02; Gaussian, Inc.: Pittsburgh, PA, 2003.
20. Tao, J. M.; Perdew, J. P.; Staroverov, V. N.; Scuseria, G. E. Phys. Rev. Lett. 2003, 91, 146401.
21. (a) Dunning, T. H., Jr. J. Chem. Phys. 1989, 90, 1007.
22. (b) Woon, D. E.; Dunning, T. H., Jr. J. Chem. Phys. 1993, 98, 1358.
23. Kubas, G. J. Metal Dihydrogen and σ-Bond Complexes; Kluwer Academic/Plenum Publishers: New York, 2001.
24. Parkin, G. Organometallics, 2006, 25, 4744.