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Gas-Phase Structure of 3,7,9-tris(trifluoromethylsulfonyl)-3,7,9-triazabicyclo[3.3.1]nonane by GED and Theoretical Calculations

The molecular structure and conformational and rotational composition of 3,7,9-tris(trifluoromethylsulfonyl)-3,7,9-triazabicyclo[3.3.1]nonane 1 have been investigated by synchronous gas-phase electron diffraction/mass spectrometry GED/MS and theoretical calculations (B3LYP and M06-2X with cc-pVTZ an...

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Detalles Bibliográficos
Autores principales:	Shainyan, Bagrat A., Eroshin, Alexey V., Mukhina, Valeriya A., Shlykov, Sergey A.
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	MDPI 2023
Materias:	Article
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10179815/ https://www.ncbi.nlm.nih.gov/pubmed/37175342 http://dx.doi.org/10.3390/molecules28093933

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