%0 DATA
%A Shunsuke, Kuwahara
%A Masaya, Nakamura
%A Akira, Yamaguchi
%A Mari, Ikeda
%A Yoichi, Habata
%D 2013
%T Combination of a New Chiroptical Probe and Theoretical Calculations for Chirality Detection of Primary Amines
%U https://acs.figshare.com/articles/journal_contribution/Combination_of_a_New_Chiroptical_Probe_and_Theoretical_Calculations_for_Chirality_Detection_of_Primary_Amines/2352937
%R 10.1021/ol402767a.s003
%2 https://acs.figshare.com/ndownloader/files/3991441
%K M conformers
%K calculation
%K amine
%K conjugate
%K chiroptical probe 1
%K ratio
%K Combination
%K probe 1
%K exciton
%K dichroism
%K New Chiroptical Probe
%K CD spectra
%K Theoretical Calculations
%K amines
%K chromophore
%K DFT
%K Primary AminesA method
%K configuration
%K Chirality Detection
%K chiral
%K amplitude
%X A method to determine absolute configurations of primary amines by combined use of a chiroptical probe **1** and theoretical calculations is reported. Probe **1** is linked to chiral primary amines yielding **1**–amine conjugates, which exhibited exciton coupled circular dichroism in the *m*-quaterphenyl chromophores. The ratios between the *P* and *M* conformers of the **1**–amine conjugates, which are calculated with DFT, were correlated highly with the sign and amplitude of the observed CD spectra.