Search Result "GIAO method"
An Improved, Efficient and Microwave Assisted Synthetic Method for the Synthesis of Chalcone Oximes: An Experimental and Computational Study
Journal: Letters in Organic Chemistry
Volume: 15 Issue: 2 Year: 2018 Page: 99-110
Author(s): Taner Erdogan,Fatma Oguz Erdogan
Organic Synthesis of Iodinated Atorvastatin via Nucleophilic Substitution Reaction: Experimental and DFT Studies
Journal: Current Organic Chemistry
Volume: 22 Issue: 20 Year: 2018 Page: 2017-2022
Author(s): Moustapha Eid Moustapha,Mohammed Geesi,Zeinab R. Farag,El Hassane Anouar
Synthesis of Novel Pyridinium Betaine Precursors from exo-Norbornene Dicarboximides
Journal: Letters in Organic Chemistry
Volume: 8 Issue: 4 Year: 2011 Page: 249-257
Author(s): Julia V. Hernandez-Madrigal, Armando Pineda-Contreras, Oscar F. Vazquez-Vuelvas, Mikhail A. Tlenkopatchev, Hector Garcia-Ortega, Ruben Gavino-Ramirez, Zeferino Gomez-Sandoval
A Comprehensive DFT Study on a Thione Compound and its Tautomer
Ebook: DFT Based Studies on Bioactive Molecules
Volume: 1 Year: 2021
Author(s): Ambrish Kumar Srivastava,Neeraj Misra
Doi: 10.2174/9789814998369121010008
Evaluation of Bio-inspired Computational Methods for Measuring Cognitive Workload
Ebook: Artificial Intelligence and Multimedia Data Engineering
Volume: 1 Year: 2023
Author(s):
Doi: 10.2174/9789815196443123010004
Synthesis, Conformational Analysis and Crystal Structure of New Thioxo, Oxo, Seleno Diastereomeric Cyclophosphamides Containing 1,3,2-dioxaphosphorinane
Journal: Current Organic Chemistry
Volume: 23 Issue: 2 Year: 2019 Page: 205-213
Author(s): Dorra Kanzari-Mnallah,Med L. Efrit,Jiří Pavlíček,Frédéric Vellieux,Habib Boughzala,Azaiez B. Akacha
Electrophilic Aromatic Synthesis of Radioiodinated Aripiprazole: Experimental and DFT Investigations
Journal: Current Organic Synthesis
Volume: 17 Issue: 4 Year: 2020 Page: 295-303
Author(s): Moustapha E. Moustapha,Mohammed H. Geesi,Zeinab R. Farag,El Hassane Anouar
Progression of Absolute Configuration Determination in Natural Product Chemistry Using Optical Rotation (Dispersion), Matrix Determinant and Electronic Circular Dichroism Methods
Journal: Current Organic Chemistry
Volume: 15 Issue: 1 Year: 2011 Page: 1843-1862
Author(s): Sheng-Ding Zhao, Lan Shen, Du-Qiang Luo, Hua-Jie Zhu
Experimental and Theoretical Approach to Novel Polyfunctionalized Isoxazole
Journal: Current Organic Chemistry
Volume: 25 Issue: 7 Year: 2021 Page: 849-856
Author(s): Amal Al-Azmi,Mona A. Shalaby
Synthesis, Conformational Analysis, Infrared, Raman and UV-Visible Spectra of Novel Schiff Bases compiled with DFT Calculations
Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 23 Issue: 7 Year: 2020 Page: 568-586
Author(s): Samy M. Ahmed,Ibrahim A. Shaaban,Elsayed H. El-Mossalamy,Tarek A. Mohamed