Unconventional ionic hydrogen bonds: CH +⋯π (CC) binding energies and structures of benzene +(acetylene) 1-4 clusters

Chemical Physics Letters

Volumn 523, Issue , 2012, Pages 25-33

  Soliman, Abdel Rahman ^a   Hamid, Ahmed M ^a   Abrash, Samuel A ^a,b   El Shall, M Samy ^a  

^a VIRGINIA COMMONWEALTH UNIVERSITY   (United States)

^b UNIVERSITY OF RICHMOND   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ACETYLENE MOLECULES; BENZENE MOLECULES; CHARGE-INDUCED DIPOLES; ENTROPY CHANGES; GASPHASE; HYDROGEN BONDING INTERACTIONS; IONIC HYDROGEN BOND; LOWEST-ENERGY ISOMERS;

ACETYLENE; BENZENE; CHARGE TRANSFER; CONDENSATION; HYDROGEN BONDS; ISOMERS; LIGHTING; MOLECULES; POSITIVE IONS;

BINDING ENERGY;

EID: 84855910031     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cplett.2011.12.015     Document Type: Article

References (45)

1. T.Y. Brooke, A.T. Tokunaga, H.A. Weaver, J. Crovisier, D. Bockelee-Morvan, and D. Crisp Nature 383 1996 606
2. C.P. McKay, and W.J. Borucki Science 276 1997 390
3. B. Fegley Space Sci. Rev. 90 1999 239
4. J. Cernicharo, M. Heras, A.G.G.M. Tielens, J.R. Pardo, F. Herpin, M. Guelin, and L.B.F.M. Waters Astrophys. J. 546 2001 L123
5. P.M. Woods, T.J. Millar, A.A. Zulstra, and E. Herbst Astrophys. J. 574 2002 L167
6. S.A. Sanford, and J. Aleon Science 314 2006 1720
7. P. Ehrenfreund, and M.A. Sephton Faraday Discuss. 133 2006 277
8. J.H. Waite Jr. Science 311 2006 1419
9. J.R. Pardo, and J. Cernicharo Astrophys. J. 654 2007 978
10. J.H. Waite Jr., D.T. Young, T.E. Cravens, A.J. Coates, F.J. Crary, B. Magee, and J. Westlake Science 316 2007 870
11. G. Strazzulla, G.A. Baratta, and F. Spinella Adv. Space Res. 15 1995 385
12. E.J. Herbst Phys. Chem. A 109 2005 4017
13. R.S. Gudipati, and L.J. Allamandola Astrophys. J. 638 2006 286
14. Y.M. Rhee, T.J. Lee, M.S. Gudipati, L.J. Allamandola, and M. Head-Gordon PNAS USA 104 2007 5274
15. Y. Ono, and C.Y. Ng J. Am. Chem. Soc. 104 1982 4752
16. J.A. Booze, and T. Baer J. Chem. Phys. 98 1993 186
17. M.T. Coolbaugh, S.G. Whitney, G. Vaidyanathan, and J.F. Garvey J. Phys. Chem. 96 1992 9139
18. P.O. Momoh, S.A. Abrash, R. Mabourki, and M.S. El-Shall J. Am. Chem. Soc. 128 2006 12408
19. P.O. Momoh, and M.S. El-Shall Chem. Phys. Lett. 436 2007 25
20. P.O. Momoh, A.R. Soliman, M. Meot-Ner, A. Ricca, and M.S. El-Shall J. Am. Chem. Soc. 130 2008 12848
21. R.A. Relph, J.C. Bopp, J.R. Roscioli, and M.A. Johnson J. Chem. Phys. 131 2009 114305
22. P.O. Momoh, A.M. Hamid, S.A. Abrash, and M.S. El-Shall J. Chem. Phys. 134 2011 204315
23. M.S. Gudipati, and L.J. Allamandola Astrophys. J. 615 2004 L177
24. D. Ascenzi, J. Aysina, P. Tosi, A. Maranzana, and G. Tonachini J. Chem. Phys. 133 2010 184308
25. D.K. Bohme, S. Wlodek, J.A. Zimmerman, and J.R. Eyler Int. J. Mass Spectrom. Ion Processes 109 1991 31
26. Y.B. Pithawalla, M. Meot-Ner, J. Gao, M.S. El-Shall, V.I. Baranov, and D.K. Bohme J. Phys. Chem. A 105 2001 3908
27. Y.M. Ibrahim, M. Meot-Ner, and M.S. El-Shall J. Phys. Chem. A. 110 2006 8585
28. M.S. El-Shall, and C. Marks J. Phys. Chem. 95 1991 4932
29. M.S. El-Shall, and Z. Yu J. Am. Chem. Soc. 118 1996 13058
30. Y.B. Pithawalla, J. Gao, Z. Yu, and M.S. El-Shall Macromolecules 29 1996 8558
31. M.J. Frisch Gaussian 03, revision C.02 2004 Gaussian, Inc. Pittsburgh, PA
32. M.J. Frisch Gaussian 09, revision A.1 2009 Gaussian Inc. Wallingford CT
33. M. Meot-Ner (Mautner) Chem. Rev. 105 2005 213
34. K.S. Kim, P. Tarakeshwar, and J.Y. Lee Chem. Rev. 100 2000 4145
35. P. Tarakeshwar, H.S. Choi, and K.S. Kim J. Am. Chem. Soc. 123 2001 3323
36. J.J. Novoa, and F. Mota Chem. Phys. Lett. 318 2000 345
37. S. Tsuzuki, K. Honda, T. Uchimara, M. Mikami, and K. Tanabe J. Am. Chem. Soc. 122 2000 3746
38. D. Philip, and J.M.A. Robinson J. Chem. Soc. Perkin Trans. 2 1998 1643
39. K. Sundararajan, K.S. Viswanathan, A.D. Kulkarni, and S.R. Gadre J. Mol. Struct. 613 2002 209
40. K. Shibasaki, A. Fujii, N. Mikami, and S. Tsuzuki J. Phys. Chem. A 111 2007 753
41. S. Tsuzuki, and A. Fujii J. Phys. Chem. Chem. Phys. 10 2008 2584
42. K. Shuler, and C.E. Dykstra J. Phys. Chem. A 104 2000 11522
43. Y. Zhao, and D.G. Truhlar Acc. Chem. Res. 41 2008 157
44. M. Meot-Ner (Mautner), and C.A. Deakyne J. Am. Chem. Soc. 107 1985 469
45. C.A. Deakyne, and M. Meot-Ner (Mautner) J. Am. Chem. Soc. 107 1985 474