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Benzyl 2-(4-bromo­anilino)-4,4-dimethyl-6-oxo­cyclo­hex-1-enecarbodithio­ate: second triclinic polymorph

The title structure, C(22)H(22)BrNOS(2), is a triclinic modification. Whereas the other reported modification crystallizes with just one mol­ecule in the asymmetric unit, the present modification has Z′ = 2. The six-membered cyclo­hexene ring adopts an envelope conformation, with the C atom bearing...

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Detalles Bibliográficos
Autores principales: El Ashry, El Sayed H., Amer, Mohammed R., Shah, M. Raza, Ng, Seik Weng
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2009
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2968632/
https://www.ncbi.nlm.nih.gov/pubmed/21582252
http://dx.doi.org/10.1107/S1600536809006151
Descripción
Sumario:The title structure, C(22)H(22)BrNOS(2), is a triclinic modification. Whereas the other reported modification crystallizes with just one mol­ecule in the asymmetric unit, the present modification has Z′ = 2. The six-membered cyclo­hexene ring adopts an envelope conformation, with the C atom bearing the two methyl groups representing the flap. This atom deviates by 0.674 (4) Å from the plane passing through the other five atoms of the ring (r.m.s. deviation = 0.027 Å). For the second independent mol­ecule, the deviation is 0.669 (3) Å and the r.m.s. deviation is 0.010 Å. The mol­ecular conformation of both mol­ecules is stabilized by intra­molecular N—H⋯S hydrogen bonds.