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A DFT Study of the Reactivity Indexes of Ionic [4 + 2+] Diels-Alder Cycloaddition to Nitrilium and Immonium Ions

Journal: Letters in Organic Chemistry
Volume: 8 Issue: 2 Year: 2011 Page: 104-107
Author(s): Raquel Castillo, Juan Andres

DFT Study and Synthesis of Novel Bioactive Bispyrazole using Mg/Al-LDH as a Solid Base Catalyst

Journal: Current Chemical Biology
Volume: 14 Issue: 4 Year: 2020 Page: 240-249
Author(s): Soufiane Akhramez,Youness Achour,Mustapha Dib,Lahoucine Bahsis,Hajiba Ouchetto,Abderrafia Hafid,Mostafa Khouili,Mohammadine El Haddad

Parabolic Reactivity “Coloring” Molecular Topology: Application to Carcinogenic PAHs

Journal: Current Organic Chemistry
Volume: 17 Issue: 23 Year: 2013 Page: 2816-2830
Author(s): Mihai V. Putz,Ottorino Ori,Franco Cataldo,Ana-Maria Putz

Understanding the Diels-Alder Reactivity of Superelectrophilic Nitrobenzofuroxans and Related 10π-Heteroaromatics through DFT-Based Electrophilicity Descriptors

Journal: Letters in Organic Chemistry
Volume: 8 Issue: 2 Year: 2011 Page: 108-118
Author(s): Sami Lakhdar, Guillaume Berionni, Regis Goumont, Francois Terrier

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 16 Issue: 8 Year: 2013 Page: 590-602
Author(s): Sanchaita Rajkhowa, Iftikar Hussain, Kalyan K. Hazarika, Pubalee Sarmah, Ramesh Chandra Deka

A New Index for the Estimation of the Aromatic Character - II

Journal: Letters in Organic Chemistry
Volume: 11 Issue: 4 Year: 2014 Page: 250-258
Author(s): Maurizio D' Auria

Elucidation of the Chemo- and Regioselectivity of Polar Diels-Alder Reactions involving Thiophene-1, 1-Dioxides Using DFT-Based Reactivity Indexes

Journal: Letters in Organic Chemistry
Volume: 8 Issue: 2 Year: 2011 Page: 95-103
Author(s): Boulanouar Messaoudi, Sidi M. Mekelleche

Conceptual Density Functional Theory of Chemical Reactivity

Ebook: Advances in Mathematical Chemistry and Applications
Volume: 1 Year: 2014
Author(s): Pratim K. Chattaraj,Debesh R. Roy
Doi: 10.2174/9781608059287114010013

Investigation of the Dyeing Ability of Some Reactive Triazine Azo DyesContaining Pyrazole Fragment

Journal: Current Organic Synthesis
Volume: 21 Issue: 3 Year: 2024 Page: 331-344
Author(s): Alaa Z. Omar,Mohamed G. Mohamed,Ezzat A. Hamed,Mohamed A. El-Atawy

Imidazole-based Derivatives as Potential Anti-platelet Inhibitors: DFT and Molecular Docking Study

Journal: Letters in Drug Design & Discovery
Volume: 13 Issue: 9 Year: 2016 Page: 888-896
Author(s): Mehbub I. K. Momin, Neil A. Koorbanally, Bahareh Honarparvar