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Crystal structure of 3,5-bis(4-chlorophenyl)-1-propyl-1,3,5-triazacyclohexane

Abstract : In the title mol­ecule, C18H21Cl2N3, the tri­aza­cyclo­hexane ring adopts a chair conformation with both 4-chloro­phenyl substituents in axial positions and the propyl group in an equatorial site. The dihedral angle between the planes of the benzene rings is 49.5 (1)°. In the crystal, mol­ecules are arranged in a head-to-tail fashion, forming columns along [010], and pairs of weak C—H⋯π inter­actions form inversion dimers between columns.
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https://hal.univ-lorraine.fr/hal-01521985
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Submitted on : Friday, May 12, 2017 - 3:55:59 PM
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Leila Lefrada, Ahcene Bouchemma, Sofiane Bouacida, Nicolas Claiser, Mohamed Souhassou. Crystal structure of 3,5-bis(4-chlorophenyl)-1-propyl-1,3,5-triazacyclohexane. Acta Crystallographica Section E: Structure Reports Online, International Union of Crystallography, 2014, 70 (9), pp.o1061 - o1062. ⟨10.1107/S1600536814019060⟩. ⟨hal-01521985⟩

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