DENSITY FUNCTIONAL THEORETICAL STUDY OF MONO-NITRATED FLUORANTHENES
Author:
Publisher
Informa UK Limited
Subject
Materials Chemistry,Organic Chemistry,Polymers and Plastics
Link
http://www.tandfonline.com/doi/pdf/10.1080/10406630802179518
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1. Nitration of Benzo[a]pyrene Adsorbed on Coal Fly Ash Particles by Nitrogen Dioxide: Role of Thermal Activation
2. Nitroarene products from the gas-phase reactions of volatile polycyclic aromatic hydrocarbons with the OH radical and N2O5
3. Diurnal concentrations of volatile polycyclic aromatic hydrocarbons and nitroarenes during a photochemical air pollution episode in Glendora, California
4. The orientation of the nitro substituent predicts the direct-acting bacterial mutagenicity of nitrated polycyclic aromatic hydrocarbons
5. Di- and Trinitrophenanthrenes: Synthesis, Separation, and Reduction Property
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1. The role of molecular properties of mononitrofluoranthenes to their mutagenic activity: Insight from ab initio and DFT calculations;Journal of the Serbian Chemical Society;2019
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3. Theoretical study on atmospheric reactions of fluoranthene and pyrene with N2O5/NO3/NO2;Chemical Physics Letters;2015-08
4. A TD-DFT study of the absorption spectra of mono-nitrated fluoranthenes;Computational and Theoretical Chemistry;2014-08
5. A DFT Study of Vibrational Spectra and Mutagenicity Predictions of Mononitrated Fluoranthenes;Polycyclic Aromatic Compounds;2013-10-20
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