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通过旋光色散、电子圆二色性和振动圆二色性光谱确定的轴向手性磺酸盐的绝对构型。

Absolute configuration of an axially chiral sulfonate determined from its optical rotatory dispersion, electronic circular dichroism, and vibrational circular dichroism spectra.

作者信息

Covington Cody L, Raghavan Vijay, Smuts Jonathan P, Armstrong Daniel W, Polavarapu Prasad L

机构信息

Department of Chemistry, Vanderbilt University, Nashville, Tennessee, USA.

Department of Chemistry, University of Texas at Arlington, Arlington, Texas, USA.

出版信息

Chirality. 2017 Nov;29(11):670-676. doi: 10.1002/chir.22739. Epub 2017 Aug 18.

Abstract

The absolute configuration (AC) of an axially chiral sulfonate (aCSO), 3,5-dimethyl-2-(naphthalen-1-yl)-6-(naphthalen-1-yl)benzenesulfonate (labeled as aCSO5), was investigated using optical rotatory dispersion (ORD), electronic circular dichroism (ECD), and vibrational circular dichroism (VCD) spectroscopies. All three methods led to the same conclusion and the AC of aCSO5 is reliably determined to be (-)-(aR, aR), or conversely (+)-(aS, aS).

摘要

使用旋光色散(ORD)、电子圆二色性(ECD)和振动圆二色性(VCD)光谱法研究了轴向手性磺酸盐(aCSO)3,5-二甲基-2-(萘-1-基)-6-(萘-1-基)苯磺酸盐(标记为aCSO5)的绝对构型(AC)。所有这三种方法都得出了相同的结论,并且可靠地确定aCSO5的AC为(-)-(aR,aR),或者相反地为(+)-(aS,aS)。

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