Chiroptical Properties of Carbo[6]Helicene Derivatives Bearing Extended π-Conjugated Cyano Substituents

One hundred years of helicene chemistry. Part 3: applications and properties of carbohelicenes

(2012) Marc Gingras   CHEMICAL SOCIETY REVIEWS

One hundred years of helicene chemistry. Part 1: non-stereoselective syntheses of carbohelicenes

(2012) Marc Gingras   CHEMICAL SOCIETY REVIEWS

One hundred years of helicene chemistry. Part 2: stereoselective syntheses and chiral separations of carbohelicenes

(2012) Marc Gingras et al.   CHEMICAL SOCIETY REVIEWS

Circular Dichroism of (Di)methyl- and Diaza[6]helicenes. A Combined Theoretical and Experimental Study

(2012) Yoshito Nakai et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Theoretical and Experimental Studies on Circular Dichroism of Carbo[n]helicenes

(2012) Yoshito Nakai et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Ruthenium-Vinylhelicenes: Remote Metal-Based Enhancement and Redox Switching of the Chiroptical Properties of a Helicene Core

(2012) Emmanuel Anger et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Helicenes: Synthesis and Applications

(2011) Yun Shen et al.   CHEMICAL REVIEWS

Multifunctional and Reactive Enantiopure Organometallic Helicenes: Tuning Chiroptical Properties by Structural Variations of Mono- and Bis(platinahelicene)s

(2011) Emmanuel Anger et al.   CHEMISTRY-A EUROPEAN JOURNAL

Aurophilicity versus Mercurophilicity: Impact of d10-d10 Metallophilic Interactions on the Structure of Metal-Rich Supramolecular Assemblies

(2011) Volodimir Vreshch et al.   CHEMISTRY-A EUROPEAN JOURNAL

Time-Dependent Density Functional Theory for Calculating Origin-Independent Optical Rotation and Rotatory Strength Tensors

(2011) Jochen Autschbach   CHEMPHYSCHEM

Folding of a Supramolecular Framework Based on a Tetrametallic Clip Driven by π−π Interactions

(2011) Tomohiro Agou et al.   INORGANIC CHEMISTRY

Tuned Range-Separated Time-Dependent Density Functional Theory Applied to Optical Rotation

(2011) Monika Srebro et al.   Journal of Chemical Theory and Computation

Optical Rotation Calculated with Time-Dependent Density Functional Theory: The OR45 Benchmark

(2011) Monika Srebro et al.   JOURNAL OF PHYSICAL CHEMISTRY A

From Hetero- to Homochiral Bis(metallahelicene)s Based on a PtIII−PtIIIBonded Scaffold: Isomerization, Structure, and Chiroptical Properties

(2011) Emmanuel Anger et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Inside Cover: Coordination-Driven Hierarchical Organization of π-Conjugated Systems: From Molecular to Supramolecular π-Stacked Assemblies (Chem. Eur. J. 24/2010)

(2010) Yishan Yao et al.   CHEMISTRY-A EUROPEAN JOURNAL

Chiral and Extended π-Conjugated Bis(2-pyridyl)phospholes as Assembling N,P,N Pincers for Coordination-Driven Synthesis of Supramolecular [2,2]Paracyclophane Analogues

(2010) Ana Isabel Aranda Perez et al.   CHEMISTRY-A EUROPEAN JOURNAL

NWChem: A comprehensive and scalable open-source solution for large scale molecular simulations

(2010) M. Valiev et al.   COMPUTER PHYSICS COMMUNICATIONS

A consistent and accurate ab initio parametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu

(2010) Stefan Grimme et al.   JOURNAL OF CHEMICAL PHYSICS

Photochemical Oxidative Cyclisation of Stilbenes and Stilbenoids—The Mallory-Reaction

(2010) Kåre B. Jørgensen   MOLECULES

Metallahelicenes: Easily Accessible Helicene Derivatives with Large and Tunable Chiroptical Properties

(2009) Lucie Norel et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Computing chiroptical properties with first-principles theoretical methods: Background and illustrative examples

(2009) Jochen Autschbach   CHIRALITY

Metal−Bis(helicene) Assemblies Incorporating π-Conjugated Phosphole-Azahelicene Ligands: Impacting Chiroptical Properties by Metal Variation

(2009) Sébastien Graule et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Simultaneous benchmarking of ground- and excited-state properties with long-range-corrected density functional theory

(2008) Mary A. Rohrdanz et al.   JOURNAL OF CHEMICAL PHYSICS

Theoretical and Experimental Investigation of Electric Field Induced Second Harmonic Generation in Tetrathia[7]helicenes

(2008) Alberto Bossi et al.   Journal of Physical Chemistry C