Structure, energetics and vibrational spectra of protonated chlortetracycline in the gas phase: An experimental and computational investigation

International Journal of Mass Spectrometry

Volumn 316-318, Issue , 2012, Pages 117-125

  Ziegler, Blake E ^a   Marta, Rick A ^a   Martens, Sabrina M ^a   Martens, Jonathan K ^a   McMahon, Terry B ^a  

^a UNIVERSITY OF WATERLOO   (Canada)

Author keywords

Electronic structure calculations; Gaseous ion structure; Gaseous ion thermochemistry; IRMPD; Tetracylcine

Indexed keywords

EID: 84860505108     PISSN: 13873806     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.ijms.2012.02.025     Document Type: Article

References (39)

1. B.M. Duggar Annals of the New York Academy of Sciences 51 1948
2. J.H. Boothe, J. Morton, J.P. Petisi, R.G. Wilkinson, and J.H. Williams Journal of the American Chemical Society 75 1953
3. L.H. Conover, W.T. Moreland, A.R. English, C.R. Stephens, and F.J. Pilgrim Journal of the American Chemical Society 75 1953
4. R. Blackwood, J.J. Beereboom, C.R. Stephens, H.H. Rennhard, and M.S. Wittenau Journal of the American Chemical Society 83 1961
5. M.J. Martell, and J.H. Boothe Journal of Medicinal Chemistry 10 1967
6. C.R. Stephens, P.N. Gordon, R.K. Blackwood, M.S. Wittenau, K. Murai, H.H. Rennhard, and J.J. Beereboom Journal of the American Chemical Society 85 1963
7. I. Chopra, and M. Roberts Microbiology and Molecular Biology Reviews 65 2001
8. I. Chopra, P.M. Hawkey, and M. Hinton Journal of Antimicrobial Chemotherapy 29 1992
9. I. Chopra Antimicrobial Agents and Chemotherapy 38 1994
10. D. Schnappinger, and W. Hillen Archives of Microbiology 165 1996
11. J. Bordner Acta Crystallographica Section B-Structural Science 35 1979
12. W. Clegg, and S.J. Teat Acta Crystallographica Section C-Crystal Structure Communications 56 2000
13. M.J. Frisch, G.W. Trucks, H.B. Schlegel, G.E. Scuseria, M.A. Robb, J.R. Cheeseman, G. Scalmani, V. Barone, B. Mennucci, G.A. Petersson, H. Nakatsuji, M. Caricato, X. Li, H.P. Hratchian, A.F. Izmaylov, J. Bloino, G. Zheng, J.L. Sonnenberg, M. Hada, M. Ehara, K. Toyota, R. Fukuda, J. Hasegawa, M. Ishida, T. Nakajima, Y. Honda, O. Kitao, H. Nakai, T. Vreven, J.A. Montgomery Jr., J.E. Peralata, F. Ogliaro, M. Bearpark, J.J. Heyd, E. Brothers, K.N. Kudin, V.N. Staroverov, R. Kobayashi, J. Normand, K. Raghavachari, A. Rendell, J.C. Burant, S.S. Iyengar, J. Tomasi, M. Cossi, N. Rega, J.M. Millam, M. Klene, J.E. Knox, J.B. Cross, V. Bakken, C. Adamo, J. Jaramillo, R. Gomperts, R.E. Stratmann, O. Yazyev, A.J. Austin, R. Cammi, C. Pomelli, J.W. Ochterski, R.L. Martin, K. Morokuma, V.G. Zakrzewski, G.A. Voth, P. Salvador, J.J. Dannenberg, S. Dapprich, A.D. Daniels, O. Farkas, J.B. Foresman, J.V. Ortiz, J. Cioslowski, and D.J. Fox Gaussian 09, Revision A.02 2009 Gaussian Inc. Wallingford, CT
14. A.D. Becke Journal of Chemical Physics 98 1993
15. R.A. Marta, R.H. Wu, K.R. Eldridge, J.K. Martens, and T.B. McMahon International Journal of Mass Spectrometry 297 2010
16. R.A. Marta, R.H. Wu, K.R. Eldridge, J.K. Martens, and T.B. McMahon Physical Chemistry Chemical Physics 12 2010
17. S.M. Martens, R.A. Marta, J.K. Martens, and T.B. McMahon Journal of Physical Chemistry A 115 2011
18. A.P. Scott, and L. Radom Journal of Physical Chemistry 100 1996
19. J.E. Delbene, W.B. Person, and K. Szczepaniak Journal of Physical Chemistry 99 1995
20. J.P. Merrick, D. Moran, and L. Radom Journal of Physical Chemistry A 111 2007
21. R.H. Wu, and T.B. McMahon Journal of the American Chemical Society 129 2007
22. R.H. Wu, and T.B. McMahon Chemphyschem 9 2008
23. K. Rajabi, K. Theel, E.A.L. Gillis, G. Beran, and T.D. Fridgen Journal of Physical Chemistry A 113 2009
24. T.R. Rizzo, J.A. Stearns, and O.V. Boyarkin International Reviews in Physical Chemistry 28 2009
25. J.A. Stearns, C. Seaiby, O.V. Boyarkin, and T.R. Rizzo Physical Chemistry Chemical Physics 11 2009
26. R.H. Wu, and T.B. McMahon Journal of Physical Chemistry B 113 2009
27. M.K. Drayss, P.B. Armentrout, J. Oomens, and M. Schaefer International Journal of Mass Spectrometry 297 2010
28. E.A.L. Gillis, and T.D. Fridgen International Journal of Mass Spectrometry 297 2010
29. W.K. Mino, J. Szczepanski, W.L. Pearson, D.H. Powell, R.C. Dunbar, J.R. Eyler, and N.C. Polfer International Journal of Mass Spectrometry 297 2010
30. J.S. Prell, T.G. Flick, J. Oomens, G. Berden, and E.R. Williams Journal of Physical Chemistry A 114 2010
31. K. Rajabi, E.A.L. Gillis, and T.D. Fridgen Journal of Physical Chemistry A 114 2010
32. D. Semrouni, O.P. Balaj, F. Calvo, C.F. Correia, C. Clavaguera, and G. Ohanessian Journal of the American Society for Mass Spectrometry 21 2010
33. R.C. Dunbar, J.D. Steill, and J. Oomens Journal of the American Chemical Society 133 2011
34. J.M. Ortega, F. Glotin, and R. Prazeres Infrared Physics & Technology 49 2006
35. V.N. Dobrynin, A.I. Gurevich, M.G. Karapetyan, M.N. Kolosov, and M.M. Shemyakin Tetrahedron Letters 1962
36. J. Donohue, K.N. Trueblood, M.S. Webster, and J.D. Dunitz Journal of the American Chemical Society 85 1963
37. A.F. Casy, and A. Yasin Journal of Pharmaceutical & Biomedical Analysis 1 1983 281
38. R.D. Curtis, and R.E. Wasylishen Canadian Journal of Chemistry-Revue Canadienne De Chimie 69 1991
39. S. Mooibroek, and R.E. Wasylishen Canadian Journal of Chemistry-Revue Canadienne De Chimie 65 1987