An ESR study on Jahn–Teller effect in corannulene monoanion

作者: Tohru Sato , Atsushi Yamamoto , Hideaki Tanaka

DOI: 10.1016/S0009-2614(00)00759-4

关键词:

摘要: Abstract Solution ESR spectra of alkali-metal-doped corannulene monoanion, C 20 H 10 − , have been observed from RT to 183 K. Eleven peaks 273 As the decrease temperature, 11 signals due ten equivalent protons split into complicated ones. This behavior has interpreted in terms pseudorotation about 5 v Jahn–Teller crossing. The potential barriers between five s wells originating fifth-order anharmonic term estimated be ca. 2.2×10 −3 eV.

参考文章(16)
H. W. Kroto, J. R. Heath, S. C. O’Brien, R. F. Curl, R. E. Smalley, C 60 : Buckminsterfullerene Nature. ,vol. 318, pp. 162- 163 ,(1985) , 10.1038/318162A0
F. Albert Cotton, Chemical applications of group theory ,(1971)
Martin Baumgarten, Lileta Gherghel, Manfred Wagner, Amir Weitz, Mordecai Rabinovitz, Pei-Chao Cheng, Lawrence T. Scott, Corannulene Reduction: Spectroscopic Detection of All Anionic Oxidation States Journal of the American Chemical Society. ,vol. 117, pp. 6254- 6257 ,(1995) , 10.1021/JA00128A012
Allen Borchardt, Augusto Fuchicello, Kathleen V. Kilway, Kim K. Baldridge, Jay S. Siegel, Synthesis and dynamics of the corannulene nucleus Journal of the American Chemical Society. ,vol. 114, pp. 1921- 1923 ,(1992) , 10.1021/JA00031A080
Richard G. Lawton, Wayne E. Barth, Synthesis of corannulene Journal of the American Chemical Society. ,vol. 93, pp. 1730- 1745 ,(1971) , 10.1021/JA00736A028
Lawrence T. Scott, Mohammed M. Hashemi, Dayton T. Meyer, Hope B. Warren, Corannulene. A convenient new synthesis Journal of the American Chemical Society. ,vol. 113, pp. 7082- 7084 ,(1991) , 10.1021/JA00018A082
S.J. Cyvin, E. Brendsdal, J. Brunvoll, M. Skaret, Corannulene as a member of circulenes: its topological properties and molecular vibrations Journal of Molecular Structure. ,vol. 247, pp. 119- 127 ,(1991) , 10.1016/0022-2860(91)87068-S
Tohru Sato, Atsushi Yamamoto, Tokio Yamabe, Electronic and Vibrational Structures of Corannulene Anions Journal of Physical Chemistry A. ,vol. 104, pp. 130- 137 ,(2000) , 10.1021/JP992912X
A. Ayalon, A. Sygula, P.-C. Cheng, M. Rabinovitz, P. W. Rabideau, L. T. Scott, Stable high-order molecular sandwiches: hydrocarbon polyanion pairs with multiple lithium ions inside and out. Science. ,vol. 265, pp. 1065- 1067 ,(1994) , 10.1126/SCIENCE.265.5175.1065
Wayne E. Barth, Richard G. Lawton, Dibenzo[ghi,mno]fluoranthene Journal of the American Chemical Society. ,vol. 88, pp. 380- 381 ,(1966) , 10.1021/JA00954A049