Loss of H2 from CH2NH+2 and NHNH+2. Reaction mechanisms and dynamics from observation of metastable ion fragmentations and ab initio calculations

International Journal of Mass Spectrometry and Ion Processes

Volumn 167-168, Issue , 1997, Pages 117-126

  Øiestad, Åse Marit Leere ^a   Uggerud, Einar ^a  

^a UNIVERSITY OF OSLO   (Norway)

Author keywords

Ab initio calculations; CH2NH+2; Loss of H2; Metastable ion fragmentations; NHNH+2

Indexed keywords

EID: 0042986281     PISSN: 01681176     EISSN: None     Source Type: Journal    
DOI: 10.1016/s0168-1176(97)00037-2     Document Type: Article

References (18)

1. D.H. Williams, G. Hvistendahl, J. Am. Chem. Soc. 96 (1974) 6753.
2. G. Hvistendahl, D.H. Williams, J. Chem. Soc., Perkin Trans. II (1975) 881.
3. For a review of previous work, see: E. Uggerud, Eur. Mass Spectrom., accepted for publication.
4. G. Hvistendahl, E. Uggerud, Org. Mass Spectrom. 20 (1985) 541.
5. G. Hvistendahl, E. Uggerud, Acta. Chem. Scand. B 42 (1988) 328.
6. K.F. Donchi, J.R. Christie, P.J. Derrick, Adv. Mass Spectrom. 8 (1980) 97.
7. S. Sæbø, Chem. Phys. Lett. 47 (1977) 564.
8. K.F. Donchi, B.A. Rumpf, G.D. Willett, J.R. Christie, P.J. Derrick, J. Am. Chem. Soc. 110 (1988) 347.
9. J.H. Beynon, R.G. Cooks, Res. Dev. 22 (1971) 26.
10. B.A. Rumpf, P.J. Derrick, Int. J. Mass Spectrom. Ion Processes 82 (1988) 239.
11. M.J. Frisch, G.W. Trucks, M. Head-Gordon, P.M.W. Gill, M.W. Wong, J.B. Foresman, B.G. Johnson, H.B. Schlegel, M.A. Robb, E.S. Replogle, R. Gomperts, J.L. Andres, K. Raghavachari, J.S. Binkley, C. Gonzalez, R.L. Martin, D.J. Fox, D.J. Defrees, J. Baker, J.J.P. Stewart, J.A. Pople, GAUSSIAN 94, Gaussian Inc., Pittsburgh, PA, 1992.
12. T. Helgaker, H.J. Aa Jensen, P. Jørgensen, H. Koch, J. Olsen, H. Ågren, K.L. Bak, V. Bakken, O. Christiansen, A. Halkier, P. Dahle, H. Heiberg, H. Hettema, D. Jonsson, R. Kobayaski, A.S. de Meras, K.V. Mikkelsen, P. Normann, K. Ruud, P.R. Taylor, O. Vaktras, DALTON, an electronic structure program.
13. J.A. Pople, A.P. Scott, M.W. Wong, L. Radom, Israel J. Chem. 33 (1993) 345.
14. T. Helgaker, E. Uggerud, H.J.A. Jensen, Chem. Phys. Lett. 173 (1990) 145.
15. A.G. Loudon, K.S. Webb, Org. Mass Spectrom. 12 (1977) 283.
16. G. Hvistendahl, E. Uggerud, Org. Mass Spectrom. 26 (1991) 67.
17. E. Uggerud, T.U. Helgaker, J. Am. Chem. Soc. 114 (1992) 4265.
18. D. Schröder, F. Grandinetti, J. Hrusak, H. Schwarz, J. Phys. Chem. 96 (1992) 4851.