Pure Appl. Chem., 2010, Vol. 82, No. 4, pp. 905-915
http://dx.doi.org/10.1351/PAC-CON-09-10-29
Published online 2010-03-20
Electronic structure of higher acenes and polyacene: The perspective developed by theoretical analyses
References
- 1. E. , F. John. Ber. Dtsch. Chem. Ges. B 63, 2967 (1930). (http://dx.doi.org/10.1002/cber.19300631109)
 - 2a. E. . Ber. Dtsch. Chem. Ges. B 72, 1817 (1939). (http://dx.doi.org/10.1002/cber.19390721002)
 - 2b. C. . Bull. Soc. Chim. 6, 1112 (1939).
 - 3. E. . Chem. Ber. 75, 1330 (1942).
 - 4. W. J. , C.-W. Liao. J. Am. Chem. Soc. 77, 992 (1955). (http://dx.doi.org/10.1021/ja01609a055)
 - 5. C. . Bull. Soc. Chim. 10, 511 (1943).
 - 6. B. , E. Clar. J. Chem. Soc. 2681 (1957). (http://dx.doi.org/10.1039/jr9570002681)
 - 7. R. , B. K. Shah, D. C. Neckers. J. Am. Chem. Soc. 128, 9612 (2006). (http://dx.doi.org/10.1021/ja063823i)
 - 8. E. Clar. Polycyclic Hydrocarbons, Academic Press, London (1964).
 - 9. C. Tönshoff, H. F. Bettinger. Angew. Chem., Int. Ed. (2010). (http://dx.doi.org/10.1002/anie200906355)
 - 10. L. , H. C. Longuet-Higgins. Proc. R. Soc. London A 255, 435 (1960).
 - 11. M. , F. Wudl, D. F. Perepichka. Chem. Rev. 104, 4891 (2004). (http://dx.doi.org/10.1021/cr030666m)
 - 12. F. . Angew. Chem., Int. Ed. 40, 1037 (2001). (http://dx.doi.org/10.1002/1521-3773(20010316)40:6<1037::AID-ANIE10370>3.0.CO;2-H)
 - 13. F. , R. Schmidt. ChemPhysChem 7, 793 (2006). (http://dx.doi.org/10.1002/cphc.200600078)
 - 14. J. E. . Chem. Rev. 106, 5028 (2006). (http://dx.doi.org/10.1021/cr050966z)
 - 15. J. E. . Angew. Chem., Int. Ed. 47, 452 (2008). (http://dx.doi.org/10.1002/anie.200604045)
 - 16a. M. , H. M. Duong, K. Starkey, K. N. Houk, E. A. Carter, F. Wudl. J. Am. Chem. Soc. 126, 7416 (2004). (http://dx.doi.org/10.1021/ja048919w)
 - 16b. Erratum: M. , H. M. Duong, K. Starkey, K. N. Houk, E. A. Carter, F. Wudl. J. Am. Chem. Soc. 126, 10493 (2004). (http://dx.doi.org/10.1021/ja045878v)
 - 17. H. C. , L. Salem. Proc. R. Soc. London A 251, 172 (1959).
 - 18. E. V. Anslyn, D. A. Dougherty. Modern Physical Organic Chemistry, University Science Books, Sausalito, CA (2006).
 - 19. R. Hoffmann. Solids and Surfaces: A Chemist’s View of Bonding in Extended Structures, Wiley-VCH, New York (1988).
 - 20. R. Peierls. Quantum Theory of Solids, Oxford University Press, London (1955).
 - 21. S. , O. L. Chapman. Phys. Rev. B 28, 7236 (1983). (http://dx.doi.org/10.1103/PhysRevB.28.7236)
 - 22. M. R. . Theor. Chim. Acta (Berl.) 23, 109 (1971). (http://dx.doi.org/10.1007/BF00530207)
 - 23. M.-H. , R. Hoffmann, R. B. Woodward. Proc. R. Soc. London A 366, 23 (1979).
 - 24. J. P. , S. A. Kafafi, J. P. LaFemina. J. Phys. Chem. 90, 6602 (1986). (http://dx.doi.org/10.1021/j100283a004)
 - 25. M. , R. Hoffmann. Solid State Commun. 47, 97 (1983). (http://dx.doi.org/10.1016/0038-1098(83)90617-8)
 - 26. N. N. , O. E. Polansky, J. Fabian. Z. Naturforsch., A: Phys. Sci. 30, 1308 (1975).
 - 27. J. L. , R. R. Chance, R. H. Baughman, R. Silbey. J. Chem. Phys. 76, 3673 (1982). (http://dx.doi.org/10.1063/1.443405)
 - 28. J. , A. C. Lilly. J. Am. Chem. Soc. 109, 4149 (1987). (http://dx.doi.org/10.1021/ja00248a004)
 - 29. K. , K. Ohzeki, S. Nankai, T. Yamabe, H. Shirakawa. J. Phys. Chem. Solids 44, 1069 (1983). (http://dx.doi.org/10.1016/0022-3697(83)90089-6)
 - 30. M. , Y. S. Lee, J. J. P. Stewart. Int. J. Quant. Chem. 35, 305 (1989). (http://dx.doi.org/10.1002/qua.560350207)
 - 31. J. , P. K. Das. J. Phys. Chem. 96, 679 (1992). (http://dx.doi.org/10.1021/j100181a031)
 - 32. B. , S. Ramasesha. Phys. Rev. B 57, 8927 (1998). (http://dx.doi.org/10.1103/PhysRevB.57.8927)
 - 33. C. , Y. A. Pati, S. Ramasesha. Phys. Rev. B 65, 155204 (2002). (http://dx.doi.org/10.1103/PhysRevB.65.155204)
 - 34. T. A. , M. Rohlfing, F. Della Sala, A. Di Carlo, T. Frauenheim. Phys. Rev. A 71, 022508 (2005). (http://dx.doi.org/10.1103/PhysRevA.71.022508)
 - 35. J. . J. Chem. Phys. 98, 473 (1993). (http://dx.doi.org/10.1063/1.464641)
 - 36. G. , T. Yamabe. J. Phys. Chem. B 105, 2534 (2001). (http://dx.doi.org/10.1021/jp003678+)
 - 37. K. N. , P. S. Lee, M. Nendel. J. Org. Chem. 66, 5517 (2001). (http://dx.doi.org/10.1021/jo010391f)
 - 38. I. . Phys. Rev. B 32, 8136 (1985). (http://dx.doi.org/10.1103/PhysRevB.32.8136)
 - 39. R. , J. A. Pople. J. Chem. Phys. 66, 3045 (1977). (http://dx.doi.org/10.1063/1.434318)
 - 40. D. , G. Dive. J. Comput. Chem. 21, 483 (2000). (http://dx.doi.org/10.1002/(SICI)1096-987X(20000430)21:6<483::AID-JCC7>3.0.CO;2-O)
 - 41. R. , R. Ahlrichs. J. Chem. Phys. 104, 9047 (1996). (http://dx.doi.org/10.1063/1.471637)
 - 42. J. , J. Paldus. J. Chem. Phys. 53, 821 (1970). (http://dx.doi.org/10.1063/1.1674065)
 - 43. S. D. , W. J. Hehre, J. A. Pople. J. Am. Chem. Soc. 109, 1871 (1987). (http://dx.doi.org/10.1021/ja00240a053)
 - 44. H. . Prog. Theor. Phys. 40, 998 (1968). (http://dx.doi.org/10.1143/PTP.40.998)
 - 45. M. , G. Piccitto, R. Pucci, P. Tomasello. Phys. Lett. A 95, 201 (1983). (http://dx.doi.org/10.1016/0375-9601(83)90835-6)
 - 46. M. M. , G. E. Vaiman, A. L. Vul’fov. J. Struct. Chem. 25, 164 (1985). (http://dx.doi.org/10.1007/BF00754218)
 - 47. M. , H. Kawabe, K. Nishikawa, S. Aono. J. Chem. Phys. 85, 3090 (1986). (http://dx.doi.org/10.1063/1.451017)
 - 48. M. P. , R. J. Watts-Tobin. J. Phys. C: Solid State Phys. 21, 825 (1988). (http://dx.doi.org/10.1088/0022-3719/21/5/003)
 - 49. H. , E. Rommel, J. Wirz. Chem. Phys. Lett. 87, 208 (1982). (http://dx.doi.org/10.1016/0009-2614(82)83589-6)
 - 50. J. , J. J. Dorando, M. Avilés, G. K.-L. Chan. J. Chem. Phys. 127, 134309 (2007). (http://dx.doi.org/10.1063/1.2768362)
 - 51. D. , S. Dai. J. Phys. Chem. A 112, 332 (2008). (http://dx.doi.org/10.1021/jp0765087)
 - 52. Z. , D. Zhang, C. Liu, Y. Jiang. J. Phys. Chem. A 113, 7909 (2009). (http://dx.doi.org/10.1021/jp9015728)
 - 53. M. C. . Phys. Rev. B 74, 045426 (2006). (http://dx.doi.org/10.1103/PhysRevB.74.045426)
 - 54. W. , M. Brauns. Ber. Dtsch. Chem. Ges. 48, 661 (1915). (http://dx.doi.org/10.1002/cber.19150480189)
 - 55. A persistent, highly substituted nonacene was recently reported: I. , M. Jazdzyk, N. N. Stein, P. Prusevich, G. P. Miller. J. Am. Chem. Soc. 132, 1261 (2010). (http://dx.doi.org/10.1021/ja9095472)
 
