Time Dependent Density Functional Theory Calculations for Electronic Circular Dichroism Spectra and Optical Rotations of Conformationally Flexible Chiral Donor−Acceptor Dyad-Reference-Cited by-同舟云学术

Time Dependent Density Functional Theory Calculations for Electronic Circular Dichroism Spectra and Optical Rotations of Conformationally Flexible Chiral Donor−Acceptor Dyad

Published:2006-11-29 Issue:26 Volume:71 Page:9797-9806
ISSN:0022-3263
Container-title:The Journal of Organic Chemistry
language:en
Short-container-title:J. Org. Chem.

Author:

Mori Tadashi¹,Inoue Yoshihisa¹,Grimme Stefan¹

Affiliation:

1. Department of Molecular Chemistry, Graduate School of Engineering, Osaka University, 2-1 Yamada-oka, Suita 565-0871, Japan, and Theoretische Organische Chemie, Organisch-Chemisches Institut der Universität Münster, Corrensstrasse 40, D-48149 Münster, Germany

Publisher

American Chemical Society (ACS)

Subject

Organic Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/jo061855i

Reference87 articles.

1. First-Principles Calculations of Protein Circular Dichroism in the Near Ultraviolet

2. Comparison between UV Raman and Circular Dichroism Detection of Short α Helices in Bombolitin III

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