Crystal structure, Hirshfeld surface and crystal void analysis, inter­molecular inter­action energies, DFT calculations and energy frameworks of 2H-benzo[b][1,4]thia­zin-3(4H)-one 1,1-dioxide

In the title mol­ecule, C(8)H(7)NO(3)S, the nitro­gen atom has a planar environment, and the thia­zine ring exhibits a screw-boat conformation. In the crystal, corrugated layers of mol­ecules parallel to the ab plane are formed by N—H⋯O and C—H⋯O hydrogen bonds together with C—H⋯π(ring) and S=O⋯π(ri...

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Detalles Bibliográficos
Autores principales: Irrou, Ezaddine, Ait Elmachkouri, Younesse, Mazzah, Ahmed, Hökelek, Tuncer, Haoudi, Amal, Mague, Joel T., Taha, Mohamed Labd, Sebbar, Nada Kheira
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2023
Materias:
Research Communications
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10626949/
https://www.ncbi.nlm.nih.gov/pubmed/37936855
http://dx.doi.org/10.1107/S205698902300868X

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10626949/
https://www.ncbi.nlm.nih.gov/pubmed/37936855
http://dx.doi.org/10.1107/S205698902300868X

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