7-Methyl-5-[(4-methylbenzene)sulfonyl]-2H,5H-[1,3]dioxolo[4,5-f]indole: crystal structure and Hirshfeld analysis

Ali, Akbar and Zukerman-Schpector, Julio and Weber Paixão, Márcio and Jotani, Mukesh M. and Tiekink, Edward R. T. * (2018) 7-Methyl-5-[(4-methylbenzene)sulfonyl]-2H,5H-[1,3]dioxolo[4,5-f]indole: crystal structure and Hirshfeld analysis. Acta Crystallographica Section E Crystallographic Communications, 74 (2). pp. 184-188. ISSN 2056-9890

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Official URL: http://dx.doi.org/10.1107/S2056989018000889

Abstract

In the title indole derivative, C17H15NO4S, the fused dioxolo-indole system is essentially planar [r.m.s. deviation of the 12 fitted atoms = 0.0249 A ˚ ] and is effectively perpendicular to the appended 4-tolyl ring, forming a dihedral angle of 89.95 (6). Overall, the molecule has the shape of the letter L. In the crystal, supramolecular layers in the ab plane are formed via weak 4-tolyl-C—H....(C6ring of indole) and S—O.... 1,3-dioxole) contacts. The aforementioned interactions along with interatomic H...H and H...O contacts are all shown to make significant contributions to the calculated Hirshfeld surfaces.

Item Type: Article
Uncontrolled Keywords: crystal structure; indole; 1,3-dioxole; Hirshfeld surface analysis
Subjects: Q Science > QD Chemistry
Divisions: Others > Non Sunway Academics
Depositing User: Dr Janaki Sinnasamy
Related URLs:
Date Deposited: 22 Jan 2018 02:21
Last Modified: 22 Apr 2019 06:02
URI: http://eprints.sunway.edu.my/id/eprint/742

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