An amide cyclophane

The title compound, 8,18-dithia-2,6-diaza-13(1,4)-piperidina-1(1,2),4(1,3),7(1,2)-tribenzenaoctadecaphane-10,15-diyne-3,6-dione, C 32 H 30 N 4 O 2 S 2 , is composed of a relatively planar bis(2-mercaptophenyl)isophthalamide unit linked to a bridging 1,4-di(but-2-yn-1-yl)piperazine unit, forming a ma...

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Veröffentlicht in:Acta crystallographica. Section E, Structure reports online Structure reports online, 2014-08, Vol.70 (8), p.o865-o865
Hauptverfasser: Viswanathan, Vijayan, Thirunarayanan, Ayyavu, Rajakumar, Perumal, Velmurugan, Devadasan
Format: Artikel
Sprache:eng
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Zusammenfassung:The title compound, 8,18-dithia-2,6-diaza-13(1,4)-piperidina-1(1,2),4(1,3),7(1,2)-tribenzenaoctadecaphane-10,15-diyne-3,6-dione, C 32 H 30 N 4 O 2 S 2 , is composed of a relatively planar bis(2-mercaptophenyl)isophthalamide unit linked to a bridging 1,4-di(but-2-yn-1-yl)piperazine unit, forming a macrocycle. The isophthalamide ring is inclined to the outer mercaptophenyl rings by 8.18 (11) and 5.59 (10)°, while these two rings are inclined to one another by 9.10 (12)°. The piperazine ring adopts a chair conformation. There are two intramolecular N—H...S hydrogen bonds generating S (5) ring motifs. In the crystal, molecules are linked via C—H...S and C—H...O hydrogen bonds, forming slabs lying parallel to (001). An O atom in the isophthalamide group is disordered over two positions with an occupancy ratio of 0.41 (6):0.59 (6).
ISSN:1600-5368
1600-5368
DOI:10.1107/S1600536814015621