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1',1''-二甲基-2'',3-二氧代-3H-二螺-[苯并[b]噻吩-2,3'-吡咯烷-2',3''-吲哚啉]-4'-羧酸乙酯的晶体结构

Crystal structure of ethyl 1',1''-dimethyl-2'',3-dioxo-3H-di-spiro-[benzo[b]thio-phene-2,3'-pyrrolidine-2',3''-indoline]-4'-carboxyl-ate.

作者信息

Savithri M P, Suresh M, Raghunathan R, Raja R, SubbiahPandi A

机构信息

Department of Physics, Queen Mary's College (Autonomous), Chennai 600 004, India.

Department of Organic Chemistry, University of Madras, Guindy Campus, Chennai 600 025, India.

出版信息

Acta Crystallogr E Crystallogr Commun. 2015 Feb 4;71(Pt 3):o142. doi: 10.1107/S2056989015002042. eCollection 2015 Mar 1.

DOI:10.1107/S2056989015002042
PMID:25844216
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC4350758/
Abstract

In the title compound, C23H22N2O4S, the pyrrolidine ring has an envelope conformation with the spiro C atom, shared with the indoline ring system, as the flap. The mean planes of the benzo-thio-phene and indoline ring systems are inclined to the mean plane of the pyrrolidine ring by 88.81 (8) and 79.48 (8)°, respectively, and to each other by 68.12 (5)°. In the crystal, mol-ecules are linked via C-H⋯O hydrogen bonds, forming chains propagating along [001].

摘要

在标题化合物C23H22N2O4S中,吡咯烷环呈信封构象,与吲哚啉环系统共用的螺碳原子作为翼片。苯并噻吩和吲哚啉环系统的平均平面分别与吡咯烷环的平均平面成88.81 (8)°和79.48 (8)°的夹角,且它们彼此之间的夹角为68.12 (5)°。在晶体中,分子通过C—H⋯O氢键相连,形成沿[001]方向延伸的链。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/664e/4350758/90125b4b3cf0/e-71-0o142-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/664e/4350758/0a6da6e7acef/e-71-0o142-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/664e/4350758/90125b4b3cf0/e-71-0o142-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/664e/4350758/0a6da6e7acef/e-71-0o142-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/664e/4350758/90125b4b3cf0/e-71-0o142-fig2.jpg

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本文引用的文献

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