Search Result "Molecular orbital energy"


Frontier Molecular Orbital Approach to the Cycloaddition Reactions

Ebook: Perhalopyridines: Synthesis and Synthetic Utility
Volume: 5 Year: 2020
Author(s): Anjandeep Kaur

An Approach to the Aromaticity Based on the Energy of the Occupied π Orbitals

Journal: Current Organic Chemistry
Volume: 20 Issue: 9 Year: 2016 Page: 971-983
Author(s): Maurizio D'Auria

Prediction of Thermal Isomerization Temperatures of Substituted Benzocyclobutenes to o-Quinodimethanes by Semi-Empirical Molecular Orbital Calculation

Journal: Letters in Organic Chemistry
Volume: 8 Issue: 2 Year: 2011 Page: 138-142
Author(s): Keisuke Chino, Takeshi Endo

Intramolecular Electron Transfer: Computational Study Based on the Orbital Deletion Procedure (ODP)

Journal: Current Organic Chemistry
Volume: 10 Issue: 7 Year: 2006 Page: 779-790
Author(s): Yirong Mo

Localization and Localizability in Quantum Organic Chemistry: Localized Orbitals and Localization Functions

Journal: Current Organic Chemistry
Volume: 15 Issue: 2 Year: 2011 Page: 3555-3565
Author(s): Bernard Silvi, Peter Reinhardt

Research Article

Digraph Energy of Directed Polygons

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 23 Issue: 0 Year: 2020 Page: 1-6
Author(s): Bo Deng,Ning Yang,Weilin Liang,Xiaoyun Lu

The Source of Energy of the Nucleus in Eukaryotic Cell is Molecular Hydrogen and High Energy Electrons

Ebook: The Art and Science of Poisons
Volume: 1 Year: 2018
Author(s): Arturo Solís Herrera,Arias Esparza, María del Carmen,Solís Arias Ruth I,Solís Arias Paola E,Solís Arias Martha P

Research Article

Computational Methods and Molecular Modelling for Some Predicted Tautomers of Pyrimidine Compounds

Journal: Current Chinese Chemistry
Volume: 1 Issue: 0 Year: 2021 Page: 1-20
Author(s): Mamdouh S. Masoud,Marwa Y. Abd El-Kaway

Translational Nascent Kinetic Energy of the CH2Cl2 Molecule After Photoexcitation Around Cl 2p Edge and its Implications to the Physics of Atmosphere

Ebook: Recent Advances in Anesthesiology
Volume: 1 Year: 2018
Author(s): K. F. Alcantara,A. B. Rocha,A.H.A. Gomes,W. Wolff,L. Sigaud,A.C.F. Santos

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