Electronic transitions in a series of 2-azaazulene polymethine dyes with different π-conjugation lengths

Chemical Physics

Volumn 411, Issue , 2013, Pages 17-25

  Przhonska, Olga V ^a,b   Hu, Honghua ^a   Webster, Scott ^a   Bricks, Julia L ^c   Viniychuk, Alexander A ^c   Kachkovski, Alexey D ^c   Slominsky, Yuriy L ^c  

^a UNIVERSITY OF CENTRAL FLORIDA   (United States)

^b INSTITUTE OF HYDROBIOLOGY   (Ukraine)

^c INSTITUTE OF ORGANIC CHEMISTRY   (Ukraine)

Author keywords

Conjugated chain; 2 Azaazulenes; Bond length alternation; Localized and delocalized molecular orbitals; Polymethine; Quantum chemical calculations; Symmetry breaking; Terminal groups; Wave of charge

Indexed keywords

EID: 84872961555     PISSN: 03010104     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.chemphys.2012.11.017     Document Type: Article

References (35)

1. A. Mishra, R.K. Behera, P.K. Behera, B.K. Mishra, and G.B. Behera Chem. Rev. 100 2000 1973
2. F. Meyers, S.R. Marder, and J.W. Perry Introduction to the nonlinear optical properties of organic materials L.V. Interrante, M.J. Hampden-Smith, Chemistry of Advanced Materials: An Overview 1998 Wiley-VCH New York
3. J. Fabian, H. Nakazumi, and M. Matsuoka Chem. Rev. 92 1992 1197
4. N. Peyghambarian, L. Dalton, A. Jen, B. Kippelen, S.R. Marder, R. Norwood, and J.W. Perry Laser Focus World 42 2006 85
5. T.D. Iordanov, J.L. Davis, A.E. Masunov, A. Levenson, O.V. Przhonska, and A.D. Kachkovski Int. J. Quantum Chem. 109 2009 3592
6. J.M. Hales, J. Matichak, S. Barlow, S. Ohira, K. Yesudas, J.-L. Brédas, J.W. Perry, and S.R. Marder Science 327 2010 1485
7. O.V. Przhonska, S. Webster, L.A. Padilha, H. Hu, A.D. Kachkovski, D.J. Hagan, E.W. Van Stryland, Two-photon absorption in near-IR conjugated molecules: design strategy and structure-property relations, in: A.P. Demchenko, (Ed.), Advanced Fluorescence Reporters in Chemistry and Biology I: Fundamentals and Molecular Design, Springer Series in Fluorescence, Springer-Verlag, Berlin Heidelberg, 2010.
8. S. Webster, L.A. Padilha, H. Hu, O.V. Przhonska, D.J. Hagan, E.W. Van Stryland, M.V. Bondar, I.G. Davydenko, Y.L. Slominsky, and A.D. Kachkovski J. Lumin. 128 2008 1927
9. L.A. Padilha, S. Webster, H. Hu, O.V. Przhonska, D.J. Hagan, E.W. Van Stryland, M.V. Bondar, I.G. Davydenko, Y.L. Slominsky, and A.D. Kachkovski Chem. Phys. 352 2008 97
10. R.S. Lepkowicz, O.V. Przhonska, J.M. Hales, J. Fu, D.J. Hagan, E.W. Van Stryland, M.V. Bondar, Y.L. Slominsky, and A.D. Kachkovski Chem. Phys. 305 2004 259
11. J.S. Craw, J.R. Reimers, G.B. Bacskay, A.T. Wong, and N.S. Hush Chem. Phys. 167 1992 77
12. J.S. Craw, J.R. Reimers, G.B. Bacskay, A.T. Wong, and N.S. Hush Chem. Phys. 167 1992 101
13. L.M. Tolbert, and X. Zhao J. Am. Chem. Soc. 119 1997 3253
14. W.P. Su, J.R. Schrieffer, and A.J. Heeger Phys. Rev. Lett. 42 1979 1698
15. J. Fabian, and H. Hartmann Dyes Pigments 79 2008 126
16. J. Fabian Dyes Pigments 84 2010 36
17. J. Bricks, A. Ryabitskii, and A. Kachkovskii Eur. J. Org. Chem. 2009 2009 3439
18. J. Bricks, A. Ryabitskii, and A. Kachkovskii Chem. Eur. J. 16 2010 8773
19. A.B. Ryabitskii, J.L. Bricks, A.D. Kachkovskii, and V.V. Kurdyukov J. Mol. Struct. 1007 2012 52
20. J.R. Lakowicz Principle of Fluorescence Spectroscopy second ed. 1999 Kluwer Academic/Plenum Publisher New York
21. A.B. Ryabitsky, A.D. Kachkovski, and O.V. Przhonska J. Mol. Struct. Theochem. 80 2 2007 75
22. J. Fu, L.A. Padilha, D.J. Hagan, E.W. Van Stryland, O.V. Przhonska, M.V. Bondar, Y.L. Slominsky, and A.D. Kachkovski J. Opt. Soc. Am. B 24 2007 56
23. S. Strickler, and R. Berg J. Chem. Phys. 37 1962 814
24. O.V. Przhonska, D.J. Hagan, E. Novikov, R. Lepkowicz, E.W. Van Stryland, M.V. Bondar, Y.L. Slominsky, and A.D. Kachkovski Chem. Phys. 273 2001 235
25. R.S. Lepkowicz, C.M. Cirloganu, O.V. Przhonska, D.J. Hagan, E.W. Van Stryland, M.V. Bondar, Y.L. Slominsky, A.D. Kachkovski, and E.I. Mayboroda Chem. Phys. 306 2004 171
26. M.J. Frisch, G.W. Trucks, H.B. Schlegel, G.E. Scuseria, M.A. Robb, J.R. Cheeseman, J.A. Montgomery Jr., T. Vreven, K.N. Kudin, J.C. Burant, M. Millam, S.S. Iyengar, J. Tomasi, V. Barone, B. Mennucci, M. Cossi, G. Scalmani, N. Rega, G.A. Petersson, H. Nakatsuji, M. Hada, M. Ehara, K. Toyota, R. Fukuda, J. Hasegawa, M. Ishida, T. Nakajima, Y. Honda, O. Kitao, H. Nakai, M. Klene, X. Li, J.E. Knox, H.P. Hratchian, J.B. Cross, C. Adamo, J. Jaramillo, R. Gomperts, R.E. Stratmann, O. Yazyev, A.J. Austin, R. Cammi, C. Pomelli, J.W. Ochterski, P.Y. Ayala, K. Morokuma, G.A. Voth, P. Salvador, J.J. Dannenberg, V.G. Zakrzewski, S. Dapprich, A.D. Daniels, M.C. Strain, O. Farkas, D.K. Malick, A.D. Rabuck, K. Raghavachari, J.B. Foresman, J.V. Ortiz, Q. Cui, A.G. Baboul, S. Clifford, J. Cioslowski, B.B. Stefanov, G. Liu, A. Liashenko, P. Piskorz, I. Komaromi, R.L. Martin, D.J. Fox, T. Keith, M.A. Al-Laham, C.Y. Peng, A. Nanayakkara, M. Challacombe, P.M.W. Gill, B. Johnson, W. Chen, M.W. Wong, C. Gonzalez, and J.A. Pople GAUSSIAN 03, Revision B.05 2003 Gaussian Inc. Pittsburgh PA 1-20
27. R. Radeglia J. Prakt. Chem. 315 1973 1121
28. G. Bach, and S. Daehne Cyanine dyes and related compounds M. Sainsbury, Rodd's Chemistry of Carbon Compounds, 2nd Supplements to second ed. 1997 Elsevier Science Amsterdam 383
29. S. Dähne Science 199 1978 1163
30. A.D. Kachkovskii Russ. Chem. Rev. 66 1997 715
31. S. Webster, J. Fu, L.A. Padilha, O.V. Przhonska, D.J. Hagan, E.W. Van Stryland, M.V. Bondar, Y.L. Slominsky, and A.D. Kachkovski Chem. Phys. 348 2008 143
32. O.D. Kachkovski, D.A. Yushchenko, G.O. Kachkovski, and N.V. Pilipchuk Dyes Pigments 66 2004 223
33. F. Terenziani, A. Painelli, C. Katan, M. Charlot, and M. Blanchard-Desce J. Am. Chem. Soc. 128 2006 15742
34. F. Terenziani, O.V. Przhonska, S. Webster, L.A. Padilha, Y.L. Slominsky, I.G. Davydenko, A.O. Gerasov, Y.P. Kovtun, M.P. Shandura, A.D. Kachkovski, D.J. Hagan, E.W. Van Stryland, and A. Painelli J. Phys. Chem. Lett. 1 2010 1800
35. A. Tomlinson, and D. Yaron J. Comput. Chem. 24 2003 1782