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3-(Adamantan-1-yl)-4-ethyl-1-[(4-phenyl-piperazin-1-yl)meth-yl]-1H-1,2,4-triazole-5(4H)-thione.


ABSTRACT: The title compound, C(25)H(35)N(5)S, has an approximately C-shaped conformation. The dihedral angle between the triazole and phenyl planes is 79.5?(2)°. The crystal structure consists of infinite chains parallel to the b axis, constructed by C-H?S hydrogen bonds between translation-related mol-ecules. Adjacent chains are linked via weak C-H?C inter-actions between the adamantyl and phenyl groups.

SUBMITTER: El-Emam AA 

PROVIDER: S-EPMC3414308 | biostudies-literature | 2012 Aug

REPOSITORIES: biostudies-literature

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3-(Adamantan-1-yl)-4-ethyl-1-[(4-phenyl-piperazin-1-yl)meth-yl]-1H-1,2,4-triazole-5(4H)-thione.

El-Emam Ali A AA   Al-Abdullah Ebtehal S ES   Al-Tuwaijri Hanaa M HM   Said-Abdelbaky Mohammed M   García-Granda Santiago S  

Acta crystallographica. Section E, Structure reports online 20120707 Pt 8


The title compound, C(25)H(35)N(5)S, has an approximately C-shaped conformation. The dihedral angle between the triazole and phenyl planes is 79.5 (2)°. The crystal structure consists of infinite chains parallel to the b axis, constructed by C-H⋯S hydrogen bonds between translation-related mol-ecules. Adjacent chains are linked via weak C-H⋯C inter-actions between the adamantyl and phenyl groups. ...[more]

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