DOI QR코드

DOI QR Code

Fluorescence and Fluorescence Excitation Spectroscopy of 5,8-Dihydroxy-1,4-naphthoquinone. Analysis of the Electronic Spectra via the Time-Dependent DFT Calculation

  • Boo, Bong Hyun (Department of Chemistry, Chungnam National University) ;
  • Kim, Ji Hwi (Department of Chemistry, Chungnam National University)
  • Received : 2012.08.23
  • Accepted : 2012.10.28
  • Published : 2013.01.20

Abstract

Keywords

References

  1. Zhao, J.; Ji, S.; Chen, Y.; Guo, H.; Yang, P. Phys. Chem. Chem. Phys. 2012, 14, 8803. https://doi.org/10.1039/c2cp23144a
  2. Stolow, A. Annu. Rev. Phys. Chem. 2003, 54, 89. https://doi.org/10.1146/annurev.physchem.54.011002.103809
  3. Hsieh, C.-C.; Jiang, C.-M.; Chou, P. T. Acc. Chem. Res. 2010, 43, 1364. https://doi.org/10.1021/ar1000499
  4. Chipem, F. A. S.; Mishra, A.; Krishnamoorthy, G. Phys. Chem. Chem. Phys. 2012, 14, 8775. https://doi.org/10.1039/c2cp23879a
  5. Scrutton, N. S.; Groot, M. L.; Heyes, D. J. Phys. Chem. Chem. Phys. 2012, 14, 8818. https://doi.org/10.1039/c2cp23789j
  6. Hsieh, C.-C.; Chou, P.-T.; Shih, C.-W.; Chuang, W.-T.; Chung, M.-W.; Lee, J.; Joo, T. J. Am. Chem. Soc. 2011, 133, 2932. https://doi.org/10.1021/ja107945m
  7. Park, S.; Kim, S.; Seo, J.; Park, Y. S. Macromol. Res. 2008, 16, 385. https://doi.org/10.1007/BF03218534
  8. Yi, P. G.; Liang, Y. H. Chem. Phys. 2006, 322, 382. https://doi.org/10.1016/j.chemphys.2005.09.019
  9. Kohn, W.; Sham, L. J. Phys. Rev. A 1965, 140, 1133. https://doi.org/10.1103/PhysRev.140.A1133
  10. Becke, A. D. Phys. Rev. A 1988, 38, 3098. https://doi.org/10.1103/PhysRevA.38.3098
  11. Becke, A. D. J. Chem. Phys. 1993, 98, 5648. https://doi.org/10.1063/1.464913
  12. Lee, C.; Yang, W.; Parr, R. G. Phys. Rev. B 1988, 37, 785. https://doi.org/10.1103/PhysRevB.37.785
  13. Dunning, T. H., Jr. J. Chem. Phys. 1989, 90, 1007. https://doi.org/10.1063/1.456153
  14. Kendall, R. A.; Dunning, T. H., Jr.; Harrison, R. J. J. Chem. Phys. 1992, 96, 6796. https://doi.org/10.1063/1.462569
  15. Wilson, A. K.; van Mourik, T.; Dunning, T. H., Jr. J. Mol. Struct. (Theochem) 1996, 388, 339. https://doi.org/10.1016/S0166-1280(96)80048-0
  16. Davidson, E. R. Chem. Phys. Lett. 1996, 260, 514. https://doi.org/10.1016/0009-2614(96)00917-7
  17. Bauernschmitt, R.; Ahlrichs, R. Chem. Phys. Lett. 1996, 256, 454. https://doi.org/10.1016/0009-2614(96)00440-X
  18. Casida, M. E.; Jamorski, C.; Casida, K. C.; Salahub, D. R. J. Chem. Phys. 1998, 108, 4439. https://doi.org/10.1063/1.475855
  19. Stratmann, R. E.; Scuseria, G. E.; Frisch, M. J. J. Chem. Phys. 1998, 109, 8218. https://doi.org/10.1063/1.477483
  20. Frisch, M. J.; Trucks, G. W.; Schlegel, H. B.; Scuseria, G. E.; Robb, M. A.; Cheeseman, J. R.; Scalmani, G.; Barone, V.; Mennucci, B.; Petersson, G. A.; Nakatsuji, H.; Caricato, M.; Li, X.; Hratchian, H. P.; Izmaylov, A. F.; Bloino, J.; Zheng, G.; Sonnenberg, J. L.; Hada, M.; Ehara, M.; Toyota, K.; Fukuda, R.; Hasegawa, J.; Ishida, M.; Nakajima, T.; Honda, Y.; Kitao, O.; Nakai, H.; Vreven, T.; Montgomery, J. A., Jr.; Peralta, J. E.; Ogliaro, F.; Bearpark, M.; Heyd, J. J.; Brothers, E.; Kudin, K. N.; Staroverov, V. N.; Kobayashi, R.; Normand, J.; Raghavachari, K.; Rendell, A.; Burant, J. C.; Iyengar, S. S.; Tomasi, J.; Cossi, M.; Rega, N.; Millam, J. M.; Klene, M.; Knox, J. E.; Cross, J. B.; Bakken, V.; Adamo, C.; Jaramillo, J.; Gomperts, R.; Stratmann, R. E.; Yazyev, O.; Austin, A. J.; Cammi, R.; Pomelli, C.; Ochterski, J. W.; Martin, R. L.; Morokuma, K.; Zakrzewski, V. G.; Voth, G. A.; Salvador, P.; Dannenberg, J. J.; Dapprich, S.; Daniels, A. D.; Farkas, O.; Foresman, J. B.; Ortiz, J. V.; Cioslowski, J.; Fox, D. J. Gaussian 09, Revision A. 1; Gaussian, Inc.; Wallingford CT, 2009.
  21. Boo, B. H.; Ryu, S. Y.; Yoon, M.; Koh, S. G.; Park, K. L. J. Phys. Chem. A 2010, 114, 8969. https://doi.org/10.1021/jp1013175
  22. Kasha, M. Discuss. Faraday Soc. 1950, 9, 14. https://doi.org/10.1039/df9500900014
  23. Reed, A. E.; Weinstock, R. B.; Weinhold, F. J. Chem. Phys. 1985, 83, 735. https://doi.org/10.1063/1.449486
  24. Lee, S. Y.; Boo, B. H.; Kang, H. K.; Kang, D.; Judai, K.; Nishijo, J.; Nishi, N. Chem. Phys. Lett. 2005, 411, 484. https://doi.org/10.1016/j.cplett.2005.05.123
  25. Collins, J. B.; Streitwieser, A. J. Comput. Chem. 1980, 1, 81. https://doi.org/10.1002/jcc.540010111

Cited by

  1. Synthesis and Characterization of Nitrogen and Sulfur Containing 1,4-Naphthoquinones vol.188, pp.12, 2013, https://doi.org/10.1080/10426507.2013.796475
  2. Novel 4,4′-Fluoresceinoxy Bisphthalonitrile Showing Aggregation-Induced Enhanced Emission and Fluorescence Turn off Behavior to Fe3+ Ions pp.1573-4994, 2019, https://doi.org/10.1007/s10895-018-02338-0
  3. Short- and Long-Term Effects of X-ray Synchrotron Radiation on Cotton Paper vol.21, pp.7, 2013, https://doi.org/10.1021/acs.biomac.0c00512