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Crystal structure of N,N,N-tris-[(1,3-benzo-thia-zol-2-yl)meth-yl]amine.

ABSTRACT: The title compound, C24H18N4S3, exhibits three near planar benzo-thia-zole systems in a pseudo-C 3 conformation. The dihedral angles between the planes of the benzo-thia-zole groups range from 112.56?(4) to 124.68?(4)° In the crystal, mol-ecules are connected to each other through three short C-H?N contacts, forming an infinite chain along [100]. The molecules are also linked by ?-? interactions with each of the three five-membered thiazole rings. [inter-centroid distance range: 3.614?(1)-4.074?(1)?Å, inter-planar distance range: 3.4806?(17)-3.6902?(15)?Å, slippage range: 0.759?(3)-1.887?(3)?Å].

SUBMITTER: Mdluli V

PROVIDER: S-EPMC4647366 | biostudies-literature | 2015 Oct

REPOSITORIES: biostudies-literature

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Crystal structure of N,N,N-tris-[(1,3-benzo-thia-zol-2-yl)meth-yl]amine.

Mdluli Velabo V Golen James A JA Rheingold Arnold L AL Manke David R DR

Acta crystallographica. Section E, Crystallographic communications 20150926 Pt 10

The title compound, C24H18N4S3, exhibits three near planar benzo-thia-zole systems in a pseudo-C 3 conformation. The dihedral angles between the planes of the benzo-thia-zole groups range from 112.56 (4) to 124.68 (4)° In the crystal, mol-ecules are connected to each other through three short C-H⋯N contacts, forming an infinite chain along [100]. The molecules are also linked by π-π interactions with each of the three five-membered thiazole rings. [inter-centroid distance range: 3.614 (1)-4.074 ...[more]

PMID: 26594479

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