The title indole derivative, C(24)H(17)Br(3)N(2)O(6)S, crystallizes with a partial occupancy [0.585â (4)] CHCl(3) solvent mol-ecule. The dihedral angles between the indole ring system and pendant nitro-benzodioxolane rings system and phenyl-sulfonyl ring are 4.81â (14) and 72.24â (19)°, respectively. In the crystal, the indole mol-ecules are linked to each other and to the chloro-form mol-ecule by weak C-Hâ¯O, C-Hâ¯Cl, C-Hâ¯Ï, C-Brâ¯Ï and C-Clâ¯Ï and aromatic Ï-Ï stacking inter-actions. A Hirshfeld surface analysis was carried out and the inter-molecular contacts with the most significant contributions are Hâ¯O/Oâ¯H (24.3%), Hâ¯H (18.4%), Brâ¯H/Hâ¯Br (16.8%) and Câ¯H/Hâ¯C (8.4%).
Crystal structure and Hirshfeld surface analysis of 3-(bromo-meth-yl)-2-[1,2-di-bromo-2-(6-nitro-benzo[d][1,3]dioxol-5-yl)eth-yl]-1-(phenyl-sulfon-yl)-1H-indole chloro-form 0.585-solvate.
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作者:Achyuta Nagaraj, Kanagasabai Somarathinam, Vinayagam Pavunkumar, Mohanakrishnan Arasambattu K, Gautham Namasivayam, Gunasekaran Krishnasamy
| 期刊: | Acta Crystallographica Section E: Crystallographic Communications | 影响因子: | 0.500 |
| 时间: | 2023 | 起止号: | 2023 Aug 17; 79(Pt 9):813-816 |
| doi: | 10.1107/S2056989023007120 | ||
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