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S—H Bond Dissociation Enthalpies in para- and meta-Substituted Thiophenols: Correlation with Thiophenolic C—S Bond Length Cover

S—H Bond Dissociation Enthalpies in para- and meta-Substituted Thiophenols: Correlation with Thiophenolic C—S Bond Length

Open Access
|May 2012

References

  1. Becke AD (1993) J. Chem. Phys. 98: 5648-5652.
  2. Binkley JS, Pople JA, Hehre WJ (1980) J. Am. Chem. Soc. 102: 939-947.
  3. Bordwell FG, Zhang X-M, Satish AV, Cheng J-P (1994) J. Am. Chem. Soc. 116: 6605-6610.
  4. Borges dos Santos RM, Muralha VSF., Correia CF, Guedes RC, Costa Cabral BJ, Simões JAM (2002) J. Phys. Chem. A 106: 9883-9889.
  5. Brinck T, Haeberlein M, Jonsson M (1997) J. Am. Chem. Soc. 119: 4239-4244.
  6. Cabral do Couto P, Costa Cabral BJ, Simões JAM (2006) Chem. Phys. Lett. 421: 504-507.
  7. Chandra AK, Nam P-C, Nguyen MT (2003) J. Phys. Chem. A 107: 9182-9188.
  8. Frisch MJ, Trucks GW, Schlegel HB, Scuseria GE, Robb MA, Cheeseman JR, Montgomery JA, Jr., Vreven T, Kudin KN, Burant JC, Millam JM, Iyengar SS, Tomasi J, Barone, B. Mennucci, M. Cossi, G. Scalmani, N. Rega, G. A. Petersson, H. Nakatsuji, M. Hada V, Ehara M, Toyota K, Fukuda R, Hasegawa J, Ishida M, Nakajima T, Honda Y, Kitao O, Nakai H, Klene M, Li X, Knox JE, Hratchian HP, Cross JB, Adamo C, Jaramillo J, Gomperts R, Stratmann RE, Yazyev O, Austin AJ, Cammi R, Pomelli C, Ochterski JW, Ayala PY, Morokuma K, Voth GA, Salvador P, Dannenberg JJ, Zakrzewski VG, Dapprich S, Daniels AD, Strain M-C, Farkas O, Malick DK, Rabuck AD, Raghavachari K, Foresman JB, Ortiz JV, Cui Q, Baboul AG, Clifford S, Cioslowski J, Stefanov BB, Liu G, Liashenko A, Piskorz P, Komaromi I, Martin RL, Fox DJ, Keith T, Al-Laham MA, Peng CY, Nanayakkara A, Challacombe M, Gill PMW, Johnson B, Chen W, Wong MW, Gonzalez C, Pople JA (2003) GAUSSIAN 03, Revision A.1, Gaussian, Inc., Pittsburgh.
  9. Gomes JRB, Ribeiro da Silva MDMC, Ribeiro da Silva MAV (2004) J. Phys. Chem. A 108: 2119-2130.
  10. Griller D, Martinho Simões JA, Wayner DDM (1990). In: Chatgilialoglu C, Asmus K-D (Eds.), Sulfur-Centered Reactive Intermediates in Chemistry and Biology, Plenum Press, New York.
  11. Gugumus F (1990) Oxidation inhibition in organic materials, Vol. 1. CRC Press, Boca Raton.
  12. Halliwell B, Gutteridge JMC (1989) Free Radicals in Biology and Medicine. Oxford University Press, Oxford.
  13. Hansch C, Leo A, Taft RW (1991) Chem. Rev. 91: 165-195.
  14. Klein E, Lukeš V (2006) J. Mol. Struct. (Theochem) 767: 43-50.10.1016/j.theochem.2006.04.017
  15. Klein E, Lukeš V, Cibulková Z, Polovková J (2006) J. Mol. Struct. (Theochem) 758: 149-159.10.1016/j.theochem.2005.10.015
  16. Klein E, Lukeš V, Ilčin M (2007) Chem. Phys. 336: 51-57.
  17. Krygowski TM, Stępień BT (2005) Chem. Rev. 105: 3482-3512.
  18. Kuwae Y, Kamachi M (1989) Bull. Chem. Soc. Jpn. 62: 2474-2479.
  19. McMillen DF, Golden DM (1982) Ann. Rev. Phys. Chem. 33: 493-532.
  20. Najafi M, Nazarparvar E, Mood KH, Zahedi M, Klein E (2011) Comput. Theor. Chem. 965: 114-122.
  21. Pankratov AN, Shalabai AV (2004) J. Struct. Chem. 45: 756-761.
  22. Pytela O (1994) Coll. Czech. Chem. Commun. 381: 159-174.
  23. Rimarčík J, Lukeš V, Klein E, Rottmannová L (2011) Comput. Theor. Chem. 967: 273-283.
  24. Vagánek A, Rimarčík J, Lukeš V, Klein E (2012) to be published.
  25. Zhang HY, Sun YM, Chen DZ (2001) Chin. Chem. Lett. 12: 75-78.
  26. Zhu Q, Zhang XM, Fry AJ (1997) Polym. Degrad. Stab. 57: 43-50.10.1016/S0141-3910(96)00224-8
DOI: https://doi.org/10.2478/v10188-012-0006-2 | Journal eISSN: 1339-3065 | Journal ISSN: 1337-978X
Language: English
Page range: 37 - 41
Published on: May 14, 2012
In partnership with: Paradigm Publishing Services
Publication frequency: 1 issue per year
Related subjects:

© 2012 Lenka Rottmannová, Adam Vagánek, Ján Rimarčík, Vladimír Lukeš, Erik Klein, published by Slovak University of Technology in Bratislava
This work is licensed under the Creative Commons License.

Volume 5 (2012): Issue 1 (April 2012)