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Acta Phys. -Chim. Sin.  2013, Vol. 29 Issue (06): 1183-1191    DOI: 10.3866/PKU.WHXB201304122
THERMODYNAMICS, KINETICS, AND STRUCTURAL CHEMISTRY     
Mirror Symmetry Breaking and Absolute Configuration Correlations of Fe(III) Complexes with Achiral Substituted o-Iminobenzosemiquinonato Ligands
ZHAO Lei, WAN Shi-Gang, CHEN Cheng-Dong, LIN Yi-Ji, FANG Xue-Ming, ZHANG Hui
State Key Laboratory of Physical Chemistry of Solid Surface, Department of Chemistry, College of Chemistry and Chemical Engineering, Xiamen University, Xiamen 361005, Fujian Province, P. R. China
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Abstract  

A pair of chiral o-iminobenzosemiquinonato Fe(III) complexes, Λ-mer- [Fe(LISQ)3] and Δ-mer-[Fe(LISQ)3] (LISQ: 2-phenylimino-4, 6-di-tert-butylphenol, mer: meridian configuration), were synthesized from 2-anilino-4,6-di-tert-butylphenol (H2L) and FeCl2·4H2O. Their absolute configurations were determined by single crystal X-ray diffraction (XRD) and solid-state circular dichroism (CD) spectra (the same single crystal for XRD was dispersed in KCl). Correlations between the absolute configurations of the chiral-atmetal o-iminobenzosemiquinonato M(III) complexes [M(LISQ)3] (M=Cr, Fe, Co) and their solid-state CD spectra were also established. Comparison between solid-state CD spectra of the bulk samples from 10 different syntheses and their single crystals were thoroughly analyzed. The solid-state CD spectra of the powdered samples from 10 different crystallizations of one product were characterized. These studies indicated that mirror symmetry breaking (MSB) occurred during the crystallization process of the Fe(III) complexes and their enantiomeric excess (ee) values were between 15% and 100%.



Key wordsSemiquinone Fe(III) complexes      Mirror symmetry breaking      Absolute configuration      Solid-state CD spectroscopy      Single crystal X-ray diffraction     
Received: 25 January 2013      Published: 12 April 2013
MSC2000:  O641  
Fund:  

The project was supported by the National Natural Science Foundation of China (21273175, 20973136).

Cite this article:

ZHAO Lei, WAN Shi-Gang, CHEN Cheng-Dong, LIN Yi-Ji, FANG Xue-Ming, ZHANG Hui. Mirror Symmetry Breaking and Absolute Configuration Correlations of Fe(III) Complexes with Achiral Substituted o-Iminobenzosemiquinonato Ligands. Acta Phys. -Chim. Sin., 2013, 29(06): 1183-1191.

URL:

http://www.whxb.pku.edu.cn/Jwk_wk/wlhx/10.3866/PKU.WHXB201304122     OR     http://www.whxb.pku.edu.cn/Jwk_wk/wlhx/Y2013/V29/I06/1183

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