C-H⋯X (X = S, P) hydrogen bonding: The complexes of halothane with dimethyl sulfide and trimethylphosphine

Journal of Molecular Structure

Volumn 1023, Issue , 2012, Pages 90-95

  Michielsen, B ^a   Verlackt, C ^a   Van Der Veken, B J ^a   Herrebout, W A ^a  

^a UNIVERSITY OF ANTWERP   (Belgium)

Author keywords

Cryospectroscopy; Halothane; Hydrogen bonding; Van der Waals molecules

Indexed keywords

AB INITIO CALCULATIONS; COMPLEXATION ENTHALPIES; CRYOSPECTROSCOPY; DIMETHYL SULFIDE; HALOTHANE; HYDROGEN-BONDED COMPLEXES; INFRARED AND RAMAN SPECTROSCOPY; MONTE CARLO SIMULATION; RED-SHIFTED; STRETCHING MODES; TRIMETHYLPHOSPHINES; VAN DER WAALS MOLECULES;

ANESTHETICS; COMPLEXATION; MONTE CARLO METHODS; RAMAN SPECTROSCOPY; VAN DER WAALS FORCES;

HYDROGEN BONDS;

EID: 84864591052     PISSN: 00222860     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.molstruc.2012.02.063     Document Type: Article

References (34)

1. M.S. Weiss, M. Brandl, J. Suhnel, D. Pal, and R. Hilgenfeld Trends Biochem. Sci. 26 2001 521
2. R.K. Castellano Curr. Org. Chem. 8 2004 845
3. S.N. Delanoye, W.A. Herrebout, and B.J. van der Veken J. Am. Chem. Soc. 124 2002 7490
4. E.A. Meyer, R.K. Castellano, and F. Diederich Angew. Chem. Int. Ed. Engl. 42 2003 1210
5. H.J. Schneider Angew. Chem. Int. Ed. Engl. 48 2009 3924
6. D. Hauchecorne, B.J. van der Veken, A. Moiana, and W.A. Herrebout Chem. Phys. 374 2010 30
7. S. Scheiner J. Phys. Chem. B 113 2009 10421
8. X. Wang, G. Zhou, A. Tian, and N.-B. Wong THEOCHEM 718 2005 1
9. M. Domagala, and S.J. Grabowski J. Phys. Chem. A 109 2005 5683
10. M. Domagala, and S.J. Grabowski Chem. Phys. 367 2010 1
11. R. Cini, G. Tamasi, and F. Botta THEOCHEM 766 2006 61
12. M.L.H. Jeng, and B.S. Ault J. Phys. Chem. 94 1990 1323
13. M. Domagala, and S.J. Grabowski Chem. Phys. 367 2010 1
14. R.F. Freitas, and S.E. Galembeck Chem. Phys. Lett. 423 2006 131
15. B. Michielsen, W.A. Herrebout, and B.J. van der Veken ChemPhysChem 8 2007 1188
16. J.J.J. Dom, B. Michielsen, B.U.W. Maes, W.A. Herrebout, and B.J. Van der Veken Chem. Phys. Lett. 469 2009 85
17. B. Michielsen, J.J.J. Dom, B.J. van der Veken, S. Hesse, Z.F. Xue, M.A. Suhm, and W.A. Herrebout Phys. Chem. Chem. Phys. 12 2010 14034
18. 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, H.X. Li, 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.J.A. Montgomery, J.E. Peralta, 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, A.S. Dapprich, D. Daniels, O. Farkas, J.B. Foresman, J.C.J.V. Ortiz, Gaussian 09, Revision A.02, Gaussian, Inc., Wallingford CT, 2009.
19. S. Simon, M. Duran, and J.J. Dannenberg J. Chem. Phys. 105 1996 11024
20. P. Popelier Atoms in Molecules. An Introduction 2000 Pearson Education Ltd. Harlow
21. W.L. Jorgensen BOSS Version 4.1 1999 Yale University New Haven
22. H.S. Biswal, and S. Wategaonkar J. Phys. Chem. A 113 2009 12763
23. D.A. McQuarrie Statistical Mechanics 2000 University Science Books Sausalito, California
24. D.C. McKean, G.P. McQuillan, W.F. Murphy, and F. Zerbetto J. Phys. Chem. 94 1990 4820
25. J.W. Ypenburg, and H. Gerding Rec. Trav. Chim. Pays-Bas 90 1971 885
26. W.F. Murphy, F. Zerbetto, J.L. Duncan, and D.C. McKean J. Phys. Chem. 97 1993 581
27. T.D. Goldfarb, and B.N. Khare J. Chem. Phys. 46 1967 3379
28. B.J. Van der Veken J. Phys. Chem. 100 1996 17436
29. B. Michielsen, W.A. Herrebout, B.J. Van der Veken, Unpublished results.
30. D.L. Howard, and H.G. Kjaergaard Phys. Chem. Chem. Phys. 10 2008 4113
31. H.S. Biswal, S. Chakraborty, and S. Wategaonkar J. Chem. Phys. 129 2008
32. H.S. Biswal, P.R. Shirhatti, and S. Wategaonkar J. Phys. Chem. A 113 2009 5633
33. H.S. Biswal, P.R. Shirhatti, and S. Wategaonkar J. Phys. Chem. A 114 2010 6944
34. H.S. Biswal, and S. Wategaonkar J. Phys. Chem. A 114 2010 5947