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(Z)-4-(2,5-Di-tert-butyl-anilino)pent-3-en-2-one.

作者信息

Pastrán Jesús, Ramírez Andrea, Agrifoglio Giuseppe, Linden Anthony, Dorta Romano

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2011 Jun 1;67(Pt 6):o1405-6. doi: 10.1107/S1600536811017296. Epub 2011 May 14.

Abstract

In the crystal structure of the title ketoamine, C(19)H(29)NO, the bond lengths from the N atom through the alkene group to the ketone O atom show the presence of an extensively delocalized π-system. The dihedral angle between the plane of the phenyl ring and that of the alkene component is 63.45 (7)° due to steric hindrance exerted by the tert-butyl groups. The mol-ecule has a Z-configured alkene function, which is facilitated by an intra-molecular N-H⋯O hydrogen bond between the amine and ketone groups. The mol-ecules are linked into extended chains, which run parallel to the [010] direction, by a very weak C-H⋯O inter-action between the methyl substituent of the alkene group and the ketone O atom of a neighbouring mol-ecule.

摘要
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/19e0/3120447/d95c315b11fe/e-67-o1405-fig1.jpg

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