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A Combined Experimental and Theoretical Study of Nitrofuran Antibiotics: Crystal Structures, DFT Computations, Sublimation and Solution Thermodynamics

Single crystal of furazolidone (FZL) has been successfully obtained, and its crystal structure has been determined. Common and distinctive features of furazolidone and nitrofurantoin (NFT) crystal packing have been discussed. Combined use of QTAIMC and Hirshfeld surface analysis allowed characterizi...

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Detalhes bibliográficos
Publicado no:Molecules
Main Authors: Manin, Alex N., Drozd, Ksenia V., Voronin, Alexander P., Churakov, Andrei V., Perlovich, German L.
Formato: Artigo
Idioma:Inglês
Publicado em: MDPI 2021
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC8201255/
https://ncbi.nlm.nih.gov/pubmed/34198944
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3390/molecules26113444
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