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首页> 外文期刊>Spectrochimica acta, Part A. Molecular and biomolecular spectroscopy >Study of electron donor-acceptor complexes of tri-n-octyl amine with [60]- and [70]fullerenes and some other electron acceptors by absorption spectrophotometric method
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Study of electron donor-acceptor complexes of tri-n-octyl amine with [60]- and [70]fullerenes and some other electron acceptors by absorption spectrophotometric method

机译:吸收分光光度法研究三正辛胺与[60]-和[70]富勒烯以及其他一些电子受体的电子给体-受体配合物

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摘要

Electron donor-acceptor (EDA) complexes of tri-n-octylamine (TOA) with [60]- and [70]fullerenes and some other electron acceptors have been studied in chloroform medium by absorption spectrophotometric technique. Charge transfer (CT) absorption bands are observed in the visible region. Vertical ionization potential of TOA was determined utilizing CT transition energy. Oscillator strengths, transition dipole strengths and resonance energies for all the complexes have been calculated. [60]Fullerene/TOA and [70]fullerene/TOA complexes are found to decay slowly with time. Kinetics of these reactions have been studied and activation energies for such processes have been estimated. Ab initio calculations suggest that complexation of [70]fullerene with TOA is enthalpy favoured. (c) 2005 Elsevier B.V. All rights reserved.
机译:通过吸收分光光度法研究了三正辛胺(TOA)与[60]-和[70]富勒烯以及其他一些电子受体的电子给体-受体(EDA)配合物。在可见光区域观察到电荷转移(CT)吸收带。利用CT跃迁能确定TOA的垂直电离势。计算了所有配合物的振荡器强度,跃迁偶极强度和共振能。发现[60]富勒烯/ TOA和[70]富勒烯/ TOA配合物随时间缓慢衰减。已经研究了这些反应的动力学,并估计了这些过程的活化能。从头算计算表明[70]富勒烯与TOA的络合是有利的。 (c)2005 Elsevier B.V.保留所有权利。

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