Ethyl 4-{[3-(adamantan-1-yl)-4-phenyl-5-sulfanyl-idene-4,5-dihydro-1H-1,2,4-triazol-1-yl]meth-yl}piperazine-1-carboxyl-ate.

Acta Crystallographica. Section E, Structure Reports Online
Ebtehal S Al-AbdullahSeik Weng Ng

Abstract

The title mol-ecule, C(26)H(35)N(5)O(2)S, displays a chair-shaped piperazine ring, as well as a planar triazole ring whose phenyl substituent is perpendicular to the mean plane of the five-membered ring [dihedral angle = 90.00 (13)°]. The methyl-ene substituent on the piperazine ring occupies an equatorial site. Weak inter-molecular C-H⋯O hydrogen bonding is present in the crystal structure. The crystal studied was a non-merohedral twin, with a 33.9 (3)% minor component.

References

Dec 25, 2007·Acta Crystallographica. Section A, Foundations of Crystallography·George M Sheldrick
Jan 28, 2009·Acta Crystallographica. Section D, Biological Crystallography·Anthony L Spek

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Citations

May 17, 2012·Acta Crystallographica. Section E, Structure Reports Online·Ali A El-EmamHoong-Kun Fun
May 17, 2012·Acta Crystallographica. Section E, Structure Reports Online·Siham LahsasniHoong-Kun Fun
Jan 24, 2014·Acta Crystallographica. Section E, Structure Reports Online·Ebtehal S Al-AbdullahHoong-Kun Fun
Jan 24, 2014·Acta Crystallographica. Section E, Structure Reports Online·Ali A El-EmamHoong-Kun Fun
Aug 21, 2012·Acta Crystallographica. Section E, Structure Reports Online·Ebtehal S Al-AbdullahHoong-Kun Fun
Aug 21, 2012·Acta Crystallographica. Section E, Structure Reports Online·Ali A El-EmamSantiago García-Granda
Aug 21, 2012·Acta Crystallographica. Section E, Structure Reports Online·Ali A El-EmamHoong-Kun Fun

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