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Methyl trans-(±)-1-oxo-2-phenethyl-3-(thio-phen-2-yl)-1,2,3,4-tetra-hydro-isoquinoline-4-carboxyl-ate.

作者信息

Akkurt Mehmet, Karaca Selvi, Bogdanov Milen G, Kandinska Meglena I, Büyükgüngör Orhan

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2009 May 14;65(Pt 6):o1287-8. doi: 10.1107/S1600536809017383.

DOI:10.1107/S1600536809017383
PMID:21583149
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC2969771/
Abstract

In the title compound, C(23)H(21)NO(3)S, the piperidine ring of the tetra-hydro-isoquinolinone unit adopts a screw-boat conformation. The thio-phene ring is disordered in a 0.700 (3):0.300 (3) ratio by an approximate 180° rotation of the ring around the C-C bond linking the ring to the tetra-hydro-isoquinolinone unit. The benzene ring of the tetra-hydro-isoquinolinone unit makes dihedral angles of 83.1 (2) and 62.38 (11)° with the major occupancy thio-phene ring and the phenyl ring, respectively. The dihedral angle between the phenyl ring and the thio-phene ring is 71.0 (2)°. In the crystal structure, mol-ecules are linked together by inter-molecular C-H⋯O and C-H⋯π inter-actions.

摘要
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/ac9b/2969771/03d01c70ff8d/e-65-o1287-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/ac9b/2969771/8b1c0deedd23/e-65-o1287-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/ac9b/2969771/03d01c70ff8d/e-65-o1287-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/ac9b/2969771/8b1c0deedd23/e-65-o1287-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/ac9b/2969771/03d01c70ff8d/e-65-o1287-fig2.jpg

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本文引用的文献

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