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Theoretical investigation of the interaction between the metal phthalocyanine [MPc]a(M = Sc, Ti, and V; a = –1, 0, and +1) complexes and formaldehyde
Formaldehyde (FA, CH(2)O) is one of the toxic volatile organic compounds that cause harmful effects on the human body. In this work, the interaction of FA gas with metal phthalocyanine (MPc) molecules was studied by employing density functional theory calculations. A variety of [MPc](a) (M = Sc, Ti,...
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| Publicado no: | Turk J Chem |
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| Autor principal: | |
| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
The Scientific and Technological Research Council of Turkey
2021
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| Assuntos: | |
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC7925323/ https://ncbi.nlm.nih.gov/pubmed/33679158 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3906/kim-2006-12 |
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