Circularly polarized luminescence and circular dichroisms in small organic molecules: correlation between excitation and emission dissymmetry factors

H Tanaka, Y Inoue, T Mori - ChemPhotoChem, 2018 - Wiley Online Library
Prompted by the recent rapid growth of interest in circularly polarized luminescence (CPL) of
organic molecules, we have collected all the reliable CPL, as well as the corresponding …

Good computational practice in the assignment of absolute configurations by TDDFT calculations of ECD spectra

G Pescitelli, T Bruhn - Chirality, 2016 - Wiley Online Library
Quantum‐mechanical calculations of chiroptical properties have rapidly become the most
popular method for assigning absolute configurations (AC) of organic compounds, including …

SpecDis: Quantifying the comparison of calculated and experimental electronic circular dichroism spectra

T Bruhn, ANU Schaumlöffel, Y Hemberger… - Chirality, 2013 - Wiley Online Library
This article outlines theory and practice of the comparison of calculated and experimental
electronic circular dichroism (ECD) curves to determine the absolute configuration of chiral …

Computing chiroptical properties with first‐principles theoretical methods: background and illustrative examples

J Autschbach - Chirality: The Pharmacological, Biological, and …, 2009 - Wiley Online Library
This “tutorial style” review outlines the theoretical foundation for computations of chiroptical
properties for optically active molecules. The formalism covers electronic and vibrational CD …

Determination of absolute configuration of natural products: theoretical calculation of electronic circular dichroism as a tool

XC Li, D Ferreira, Y Ding - Current organic chemistry, 2010 - ingentaconnect.com
Determination of absolute configuration (AC) is one of the most challenging features in the
structure elucidation of chiral natural products, especially those with complex structures …

[图书][B] Chiroptical spectroscopy: fundamentals and applications

PL Polavarapu - 2016 - taylorfrancis.com
This book details chiroptical spectroscopic methods: electronic circular dichroism (ECD),
optical rotatory dispersion (ORD), vibrational circular dichroism (VCD), and vibrational …

Circular dichroism calculation for natural products

AE Nugroho, H Morita - Journal of natural medicines, 2014 - Springer
Determination of the absolute configuration (AC) is often a challenging aspect in the
structure elucidation of natural products. When chiral compounds possess appropriate …

Absolute configuration determination by quantum mechanical calculation of chiroptical spectra: Basics and applications to fungal metabolites

S Superchi, P Scafato, M Gorecki… - Current medicinal …, 2018 - ingentaconnect.com
Background: Quantum mechanical simulations of chiroptical properties, such as electronic
circular dichroism (ECD), optical rotation (OR), and vibrational circular dichroism (VCD) …

Organocatalytic synthesis of spiro compounds via a cascade Michael–Michael-aldol reaction

X Companyó, A Zea, ANR Alba, A Mazzanti… - Chemical …, 2010 - pubs.rsc.org
The synthesis of spiro compounds via a Michael–Michael-aldol reaction is reported. The
reaction affords spirooxindole derivatives in good yields and in almost diastereo-and …

Enantioselective gold-catalyzed synthesis of polycyclic indolines

G Cera, M Chiarucci, A Mazzanti, M Mancinelli… - Organic …, 2012 - ACS Publications
The synthesis of architecturally complex polycyclic fused indolines is achieved in a chemo-,
regio-, and stereodefined manner, via an enantioselective gold-catalyzed cascade …