A DFT study on dihydropyrazine annulated linear polyacenes: aromaticity, stability and HOMO–LUMO energy modulation

Synchronous double C–N bond formation via C–H activation for a novel synthetic route to phenazine

(2016) Kapileswar Seth et al.   CHEMICAL COMMUNICATIONS

The Palladium Way to N-Heteroacenes

(2016) Uwe H. F. Bunz et al.   CHEMISTRY-A EUROPEAN JOURNAL

Halogenated Symmetrical Tetraazapentacenes: Synthesis, Structures, and Properties

(2016) Jens U. Engelhart et al.   JOURNAL OF ORGANIC CHEMISTRY

Quantification of Aromaticity Based on Interaction Coordinates: A New Proposal

(2016) Sarvesh Kumar Pandey et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Coronene-Containing N-Heteroarenes: 13 Rings in a Row

(2016) Alexander H. Endres et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Synthesis of Ethano-Bridged Diazapolycenes as Potential Precursors for Diazapolycenes and Their Properties

(2016) Moinul Karim et al.   MOLECULES

The remarkable ability of anions to bind dihydrogen

(2016) Therese Davis Della et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Carbon rings: a DFT study on geometry, aromaticity, intermolecular carbon–carbon interactions and stability

(2016) Karunakaran Remya et al.   RSC Advances

The Larger Linear N-Heteroacenes

(2015) Uwe H. F. Bunz   ACCOUNTS OF CHEMICAL RESEARCH

Quantifying aromaticity with electron delocalisation measures

(2015) Ferran Feixas et al.   CHEMICAL SOCIETY REVIEWS

Highly Ordered Phenanthroline-Fused Azaacene

(2015) Cunbin An et al.   CRYSTAL GROWTH & DESIGN

Formation and Chlorination of Carbazole, Phenoxazine, and Phenazine

(2015) Mohammednoor Altarawneh et al.   ENVIRONMENTAL SCIENCE & TECHNOLOGY

Non-covalent intermolecular carbon–carbon interactions in polyynes

(2015) Karunakaran Remya et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Ten Years of N-Heteropentacenes as Semiconductors for Organic Thin-Film Transistors

(2014) Qian Miao   ADVANCED MATERIALS

Aromaticity from the Viewpoint of Molecular Geometry: Application to Planar Systems

(2014) Tadeusz M. Krygowski et al.   CHEMICAL REVIEWS

Phenazines and TheirN-Oxides as Products of Cyclization ofN-Aryl-2-nitrosoanilines - Disproof of the Reported Homolytic Cross-Coupling Process Leading to Benzo[c]cinnoline Oxides

(2014) Zbigniew Wróbel et al.   EUROPEAN JOURNAL OF ORGANIC CHEMISTRY

Assessment of Ring Current Models for Monocycles

(2014) Guglielmo Monaco et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Transition-Metal-Free Tandem Oxidative Removal of Benzylic Methylene Group by C–C and C–N Bond Cleavage Followed by Intramolecular New Aryl C–N Bond Formation under Radical Conditions

(2014) Joydev K. Laha et al.   ORGANIC LETTERS

Synthesis of tetraazatetracenes and -pentacenes: role of the substituents for their stability

(2014) Michaela Märken et al.   PURE AND APPLIED CHEMISTRY

Which density functional is close to CCSD accuracy to describe geometry and interaction energy of small noncovalent dimers? A benchmark study using Gaussian09

(2013) Karunakaran Remya et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

Synthesis and Properties of Diazapentacene Diimides

(2013) Cheng Li et al.   Asian Journal of Organic Chemistry

Forty years of Clar's aromatic π-sextet rule

(2013) Miquel Solà   Frontiers in Chemistry

Intermolecular Oxidative Annulation of 2-Aminoanthracenes to Diazaacenes and Aza[7]helicenes

(2012) Kiyohiko Goto et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Dearomatizing conversion of pyrazines to 1,4-dihydropyrazine derivatives via transition-metal-free diboration, silaboration, and hydroboration

(2012) Kazuyuki Oshima et al.   CHEMICAL COMMUNICATIONS

Synthesis and Optical Properties of Diaza- and Tetraazatetracenes

(2012) Benjamin D. Lindner et al.   CHEMISTRY-A EUROPEAN JOURNAL

Doped Polycyclic Aromatic Hydrocarbons as Building Blocks for Nanoelectronics: A Theoretical Study

(2012) Pavlo O. Dral et al.   JOURNAL OF ORGANIC CHEMISTRY

Synthesis of phenazines by Cu-catalyzed homocoupling of 2-halogen anilines in water

(2012) Lintao Yu et al.   JOURNAL OF ORGANOMETALLIC CHEMISTRY

Effect of Fluorine Substitution on the Aromaticity of Polycyclic Hydrocarbons

(2012) Mikko Kaipio et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Theoretical Investigations on Charge-Transfer Properties of Novel High Mobility n-Channel Organic Semiconductors – Diazapentacene Derivatives

(2012) Xin Wang et al.   Journal of Physical Chemistry C

Large Azaacenes: Pyridine Rings Reacting Like Carbonyl Groups

(2012) Jens U. Engelhart et al.   ORGANIC LETTERS

N-Heteropentacenes and N-Heteropentacenequinones: From Molecules to Semiconductors

(2012) Qian Miao   SYNLETT

An Efficient Synthesis of Tetraazapentacenes

(2011) Olena Tverskoy et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

High mobility n-channel single-crystal field-effect transistors based on 5,7,12,14-tetrachloro-6,13-diazapentacene

(2011) Md. Minarul Islam et al.   CHEMICAL COMMUNICATIONS

Acenes vs N-Heteroacenes: The Effect of N-Substitution on the Structural Features of Crystals of Polycyclic Aromatic Hydrocarbons

(2011) Kenneth E. Maly   CRYSTAL GROWTH & DESIGN

Synthesis of Tetrachloro-azapentacene as an Ambipolar Organic Semiconductor with High and Balanced Carrier Mobilities

(2011) Cheng-Li Song et al.   ORGANIC LETTERS

Size dependences of the diradical character and the second hyperpolarizabilities in dicyclopenta-fused acenes: relationships with their aromaticity/antiaromaticity

(2011) Shuto Motomura et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Photogeneration of Octacene and Nonacene

(2010) Christina Tönshoff et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Gas-phase infrared spectra of cationized nitrogen-substituted polycyclic aromatic hydrocarbons

(2010) H. Alvaro Galué et al.   ASTRONOMY & ASTROPHYSICS

Pictorial representation and validation of Clar's aromatic sextet theory using molecular electrostatic potentials

(2010) Kunduchi Periya Vijayalakshmi et al.   NEW JOURNAL OF CHEMISTRY

Effects of electronegative substitution on the optical and electronic properties of acenes and diazaacenes

(2010) Anthony Lucas Appleton et al.   Nature Communications

Diazapentacene Derivatives as Thin-Film Transistor Materials: Morphology Control in Realizing High-Field-Effect Mobility

(2009) Shou-Zheng Weng et al.   ACS Applied Materials & Interfaces

What is… aromaticity: a critique of the concept of aromaticity—can it really be defined?

(2009) Amnon Stanger   CHEMICAL COMMUNICATIONS

A Meaningful Analogue of Pentacene: Charge Transport, Polymorphs, and Electronic Structures of Dihydrodiazapentacene

(2009) Qin Tang et al.   CHEMISTRY OF MATERIALS

N-Heteroacenes

(2009) Uwe H. F. Bunz   CHEMISTRY-A EUROPEAN JOURNAL

Density Functionals with Broad Applicability in Chemistry

(2008) Yan Zhao et al.   ACCOUNTS OF CHEMICAL RESEARCH

On the performance of some aromaticity indices: A critical assessment using a test set

(2008) Ferran Feixas et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

Polyacenes electronic properties and their dependence on molecular size

(2008) Rohoullah Firouzi et al.   JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM

The Larger Acenes: Versatile Organic Semiconductors

(2007) John E. Anthony   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION