Interactions of Substituted Nitroaromatics with Model Graphene Systems: Applicability of Hammett Substituent Constants To Predict Binding Energies

[Image: see text] Applicability of Hammett parameters (σ(m) and σ(p)) was tested in extended π-systems in gas phase. Three different model graphene systems, viz. 5,5-graphene (GR), 3-B-5,5-graphene (3BGR), and 3-N-5,5-graphene (3NGR), were designed as extended π-systems, and interactions of various...

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Detalles Bibliográficos
Autores principales: Khan, Mehedi H., Leszczynska, Danuta, Majumdar, D., Roszak, Szczepan, Leszczynski, Jerzy
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2018
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6641519/
https://www.ncbi.nlm.nih.gov/pubmed/31458554
http://dx.doi.org/10.1021/acsomega.7b01912

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6641519/
https://www.ncbi.nlm.nih.gov/pubmed/31458554
http://dx.doi.org/10.1021/acsomega.7b01912

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