Title of article :
Crystal structure of 2-[(3aS,6R)-3,3,6-tri­methyl-3,3a,4,5,6,7-hexa­hydro-2H-indazol-2-yl]thia­zol-4(5H)-one
Author/Authors :
N'ait Ousidi, Abdellah Laboratoire de Physico-Chimie Moléculaire et Synthèse Organique - Département de Chimie - Faculté des Sciences, Morocco , Ait Itto, My Youssef Laboratoire de Physico-Chimie Moléculaire et Synthèse Organique - Département de Chimie - Faculté des Sciences, Morocco , Auhmani, Aziz Laboratoire de Physico-Chimie Moléculaire et Synthèse Organique - Département de Chimie - Faculté des Sciences, Morocco , Riahi, Abdelkhalek Institut de Chimie Moléculaire de Reims, France , Daranc, Jean-Claude Institut de Chimie Moléculaire de Reims, France , Abdelwahed, Auhmani Laboratoire de Physico-Chimie Moléculaire et Synthèse Organique - Département de Chimie - Faculté des Sciences, Morocco
Pages :
10
From page :
1
To page :
10
Abstract :
The title compound, C13H19N3OS, is a new thia­zolidin-4-one derivative prepared and isolated as the pure (3aS,6R)-diastereisomer from (R)-thio­semicarbazone pulegone. It crystallized with two independent mol­ecules (A and B) in the asymmetric unit. The compound is composed of a hexhydro­indazole ring system (viz. a five-membered di­hydro­pyrazole ring fused to a cyclo­hexyl ring) with a thia­zole-4-one ring system attached to one of the pyrazole N atoms (at position 2). The overall geometry of the two mol­ecules differs slightly, with the mean planes of the pyrazole and thia­zole rings being inclined to one another by 10.4 (1)° in mol­ecule A and 0.9 (1)° in mol­ecule B. In the crystal, the A and B mol­ecules are linked via C—H⋯O hydrogen bonds, forming slabs parallel to the ab plane. There are C—H⋯π inter­actions present within the layers, and between the layers, so forming a three-dimensional structure.
Keywords :
indazole , thia­zolidinone , crystal structure , absolute structure , heterocyclic compounds , C—H⋯π inter­actions. , C—H⋯O hydrogen bonding
Journal title :
Acta Crystallographica Section E: Crystallographic Communications
Serial Year :
2016
Full Text URL :
Record number :
2617370
Link To Document :
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