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Citation: AN Cai-Xia, HOU Rui-Bin, QIU Han, ZHAO Liang, YIN Bing-Zhu, SU Zhong-Min. Synthesis and Theoretical Calculation for Non-linear Properties of Pyrrolotetrathiafulvalene-Based D-π-A Diads[J]. Chinese Journal of Applied Chemistry, ;2009, 26(7): 795-800. shu

Synthesis and Theoretical Calculation for Non-linear Properties of Pyrrolotetrathiafulvalene-Based D-π-A Diads

1.
a MOE Key Laboratory of Organism Functional Factors of the Changbai Mountain, Yanbian University, Yanji 133002;
2.
b College of Chemistry & Chemical Engineering, Henan Institute of Science and Technology, Xinxiang;
3.
c School of Chemistry, Northeast Normal University, Changchun

Corresponding author: YIN Bing-Zhu,
Received Date: 26 June 2008
Available Online: 20 September 2008
Fund Project: 国家自然科学基金(20462001,20662010) (20462001,20662010)教育部博士学科点科研专项基金(20060184001)资助项目 (20060184001)

Two tetrathiafulvalene-based D-π-A diad compounds(6a,7a) were prepared from starting compound(1) via Vilsmeier formylation and Wittig reaction or cross-coupling reaction.To study the effect of the N-methyl,two N-methylated D-π-A diad analogues(6b,7b) were also synthesized from the interme-diate(2) via the same process.Their electrochemical and photophysical properties were studied with cyclic voltammetry and UV-Vis spectrometry,and theoretical calculations were carried out for their third-order nonlinear optical properties.Experimental results showed that the maximum absorption wavelengths of the target compounds were 325~383 nm and the results calculated showed that compounds 7a and 7b with a longer conjugated structure possessed better third-order nonliner susceptibilities,and their γ values were 5×10^-33 esu at λ=1 064 nm.
- pyrrolotetrathiafulvalene,
- electrochemistry,
- photophysical properties,
- nonlinear optics,
- theoretical calculation
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