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Crystal structure and Hirshfeld surface analysis of 3-(bromo­meth­yl)-2-[1,2-di­bromo-2-(6-nitro­benzo[d][1,3]dioxol-5-yl)eth­yl]-1-(phenyl­sulfon­yl)-1H-indole chloro­form 0.585-solvate

The title indole derivative, C(24)H(17)Br(3)N(2)O(6)S, crystallizes with a partial occupancy [0.585 (4)] CHCl(3) solvent mol­ecule. The dihedral angles between the indole ring system and pendant nitro­benzodioxolane rings system and phenyl­sulfonyl ring are 4.81 (14) and 72.24 (19)°, respectively. I...

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Detalles Bibliográficos
Autores principales: Achyuta, Nagaraj, Kanagasabai, Somarathinam, Vinayagam, Pavunkumar, Mohanakrishnan, Arasambattu K., Gautham, Namasivayam, Gunasekaran, Krishnasamy
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2023
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10483562/
https://www.ncbi.nlm.nih.gov/pubmed/37693675
http://dx.doi.org/10.1107/S2056989023007120
Descripción
Sumario:The title indole derivative, C(24)H(17)Br(3)N(2)O(6)S, crystallizes with a partial occupancy [0.585 (4)] CHCl(3) solvent mol­ecule. The dihedral angles between the indole ring system and pendant nitro­benzodioxolane rings system and phenyl­sulfonyl ring are 4.81 (14) and 72.24 (19)°, respectively. In the crystal, the indole mol­ecules are linked to each other and to the chloro­form mol­ecule by weak C—H⋯O, C—H⋯Cl, C—H⋯π, C—Br⋯π and C—Cl⋯π and aromatic π–π stacking inter­actions. A Hirshfeld surface analysis was carried out and the inter­molecular contacts with the most significant contributions are H⋯O/O⋯H (24.3%), H⋯H (18.4%), Br⋯H/H⋯Br (16.8%) and C⋯H/H⋯C (8.4%).