Electronic spectra of protonated benzaldehyde clusters with Ar and N 2: Effect of ππ* excitation on the intermolecular potential

Journal of Physical Chemistry A

Volumn 114, Issue 48, 2010, Pages 12600-12604

  Patzer, Alexander ^a   Zimmermann, Max ^a   Alata, Ivan ^b   Jouvet, Christophe ^b   Dopfer, Otto ^a  

^a TECHNISCHE UNIVERSITÄT BERLIN   (Germany)

^b UNIVERSITÉ PARIS SACLAY   (France)

Author keywords

[No Author keywords available]

Indexed keywords

AB INITIO CALCULATIONS; CIS ISOMERS; ELECTRONIC SPECTRUM; H-BONDED; H-BONDING; H-BONDS; HIGHER FREQUENCIES; INTERMOLECULAR POTENTIALS; PROTON AFFINITY; PROTONATED;

ALDEHYDES; ELECTRONIC STRUCTURE; HYDROGEN BONDS; MASS SPECTROMETRY; PROTONATION;

ARGON;

ARGON; BENZALDEHYDE DERIVATIVE; LIGAND; NITROGEN; PROTON;

ARTICLE; CHEMISTRY; DIMERIZATION; PHOTOCHEMISTRY; QUANTUM THEORY; SPECTROSCOPY; THERMODYNAMICS;

ARGON; BENZALDEHYDES; DIMERIZATION; LIGANDS; NITROGEN; PHOTOCHEMISTRY; PROTONS; QUANTUM THEORY; SPECTRUM ANALYSIS; THERMODYNAMICS;

EID: 78649885423     PISSN: 10895639     EISSN: 15205215     Source Type: Journal    
DOI: 10.1021/jp109949y     Document Type: Article

References (46)

1. Müller-Dethlefs, K.; Dopfer, O.; Wright, T. G. Chem. Rev. 1994, 94, 1845
2. Hobza, P.; Müller-Dethlefs, K. Non-Covalent Interactions; The Royal Society of Chemistry: Cambridge, U.K., 2010.
3. Zhang, X.; Knee, J. L. Faraday Discuss. 1994, 97, 299
4. Kleinermanns, K.; Gerhards, M.; Schmitt, M. Ber. Bunsenges. Phys. Chem. 1997, 101, 1785
5. Brutschy, B. Chem. Rev. 2000, 100, 3891
6. Dopfer, O. Z. Phys. Chem. 2005, 219, 125
7. Ebata, T.; Fujii, A.; Mikami, N. Int. Rev. Phys. Chem. 1998, 17, 331
8. Gonohe, N.; Abe, H.; Mikami, N.; Ito, M. J. Phys. Chem. 1985, 89, 3642
9. Neusser, H. J.; Krause, H. Chem. Rev. 1994, 94, 1829
10. Neusser, H. J.; Siglow, K. Chem. Rev. 2000, 100, 3921
11. Kang, C.; Pratt, D. W. Int. Rev. Phys. Chem. 2005, 24, 1
12. Meyer, E. A.; Castellano, R. K.; Diederich, F. Angew. Chem., Int. Ed. 2003, 42, 1210
13. Solcà, N.; Dopfer, O. Angew. Chem., Int. Ed. 2002, 41, 3628
14. Solcà, N.; Dopfer, O. Chem.-Eur. J. 2003, 9, 3154
15. Douberly, G. E.; Ricks, A. M.; Schleyer, P. V. R.; Duncan, M. A. J. Phys. Chem. A 2008, 112, 4869
16. Solcà, N.; Dopfer, O. Chem. Phys. Lett. 2001, 342, 191
17. Solcà, N.; Dopfer, O. J. Am. Chem. Soc. 2004, 126, 1716
18. Pasker, F.; Solcà, N.; Dopfer, O. J. Phys. Chem. A 2006, 110, 12793
19. Solcà, N.; Dopfer, O. Angew. Chem., Int. Ed. 2003, 42, 1537
20. Chakraborty, S.; Patzer, A.; Dopfer, O. J. Chem. Phys. 2010, 133 044307
21. Rizzo, T. R.; Stearns, J. A.; Boyarkin, O. V. Int. Rev. Phys. Chem. 2009, 28, 481
22. Nagornova, N. S.; Rizzo, T. R.; Boyarkin, O. V. J. Am. Chem. Soc. 2010, 132, 4040
23. Fujihara, A.; Matsumoto, H.; Shibata, Y.; Ishikawa, H.; Fuke, K. J. Phys. Chem. A 2008, 112, 1457
24. Bakker, J. M.; Sinha, R. K.; Besson, T.; Brugnara, M.; Tosi, P.; Salpin, J. Y.; Maitre, P. J. Phys. Chem. A 2008, 112, 12393
25. Polfer, N. C.; Oomens, J. Mass Spectrom. Rev. 2009, 28, 468
26. Eyler, J. R. Mass Spectrom. Rev. 2009, 28, 448
27. Fridgen, T. D. Mass Spectrom. Rev. 2009, 28, 586
28. Prell, J. S.; Chang, T. M.; O'Brien, J. T.; Williams, E. R. J. Am. Chem. Soc. 2010, 132, 7811
29. Chiavarino, B.; Crestoni, M. E.; Fornarini, S.; Dopfer, O.; Lemaire, J.; Maitre, P. J. Phys. Chem. A 2006, 110, 9352
30. Alata, I.; Omidyan, R.; Dedonder-Lardeux, C.; Broquier, M.; Jouvet, C. Phys. Chem. Chem. Phys. 2009, 11, 11479
31. Freiser, B. S.; Beauchamp, J. L. J. Am. Chem. Soc. 1977, 99, 3214
32. Rappoport, Z. The Chemistry of Phenols; Wiley: Weinheim, 2003.
33. Antol, I.; Eckert-Maksic, M.; Klessinger, M. J. Mol. Struct. (THEOCHEM) 2003, 664-665, 309
34. Mercier, S. R.; Boyarkin, O. V.; Kamariotis, A.; Guglielmi, M.; Tavernelli, I.; Cascella, M.; Rothlisberger, U.; Rizzo, T. R. J. Am. Chem. Soc. 2006, 128, 16938
35. Chakraborty, S.; Omidyan, R.; Alata, I.; Nielsen, I. B.; Dedonder-Lardeux, C.; Broquier, M.; Jouvet, C. J. Am. Chem. Soc. 2009, 131, 11091
36. Dopfer, O. Int. Rev. Phys. Chem. 2003, 22, 437
37. Ahlrichs, R.; Bär, M.; Häser, M.; Horn, H.; Kölmel, C. Chem. Phys. Lett. 1989, 162, 165
38. Western, C. M. PGOPHER, version 7.0, A Program for Simulating Rotational Structure; University of Bristol, http://pgopher.chm.bris.ac.uk.
39. Chakraborty, S.; Patzer, A.; Lagutschenkov, A.; Langer, J.; Dopfer, O. Chem. Phys. Lett. 2010, 485, 49
40. Roth, D.; Dopfer, O. Phys. Chem. Chem. Phys. 2002, 4, 4855
41. Bieske, E. J.; Dopfer, O. Chem. Rev. 2000, 100, 3963
42. Alata, I.; Omidyan, R.; Broquier, M.; Dedonder, C.; Dopfer, O.; Jouvet, C. Phys. Chem. Chem. Phys. 2010, 12, 14456.
43. Silva, C. R.; Reilly, J. P. J. Phys. Chem. 1996, 100, 17111
44. Hunter, E. P. L.; Lias, S. G. J. Phys. Chem. Ref. Data 1998, 27, 413
45. Kalkman, I.; Brand, C.; Vu, C.; Meerts, W. L.; Svartsov, Y. N.; Dopfer, O.; Müller-Dethlefs, K.; Grimme, S.; Schmitt, M. J. Chem. Phys. 2009, 130, 224303
46. Solcà, N.; Dopfer, O. Chem. Phys. Lett. 2000, 325, 354