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Simazine inclusion complexes with cucurbiturils (n = 6–8): experimental and molecular dynamics studies

Abstract Simazine (SIM) inclusion complexes with cucurbit[n]uril, CBn, (n = 6–8), have been studied in both aqueous solutions and solid states. NMR measurements were taken in DMSO. The solid samples were examined using Fourier transform infrared spectroscopy (FTIR) and powder X-ray diffraction (PXRD...

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Principais autores: Abdalla A. Elbashir, Maali Saad Mokhtar, FakhrEldin O. Suliman, Amel Y. Ahmed
Format: Artigo
Sprog:Inglês
Udgivet: Nature Portfolio 2025-12-01
Serier:Scientific Reports
Fag:
Cucurbituril
Host-guest chemistry
Supramolecular
Simazine
Inclusion complex
Molecular dynamics
Online adgang:https://doi.org/10.1038/s41598-025-32843-9
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