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5''-氯-1',1''-二甲基-2,2''-二氧代二螺-[吲哚啉-3,2'-吡咯烷-3',3''-吲哚啉]-4'-羧酸甲酯

Methyl 5''-chloro-1',1''-dimethyl-2,2''-dioxodi-spiro-[indoline-3,2'-pyrrolidine-3',3''-indoline]-4'-carboxyl-ate.

作者信息

Kannan Piskala Subburaman, Yuvaraj Panneerselvam, Manivannan Karthikeyan, Reddy Boreddy Siva Rami, Subbiahpandi Arunachalathevar

机构信息

Department of Physics, S.M.K. Fomra Institute of Technology, Thaiyur, Chennai 603 103, India.

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2013 May 4;69(Pt 6):o825-6. doi: 10.1107/S1600536813011501. Print 2013 Jun 1.

DOI:10.1107/S1600536813011501
PMID:23795016
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC3684914/
Abstract

In the title compound, C22H20ClN3O4, the central pyrrolidine ring adopts an envelope conformation on the N atom. The indolinone systems are individually roughly planar, with maximum deviations from their mean planes of 0.130 Å for the spiro C atom of the indolinone unit and 0.172 Å for the carbonyl C atom of the 5-chloro-1-methyl-indolinone unit. They make dihedral angles of 77.7 (8) and 86.1 (8)° with the mean plane through the central pyrrolidine ring. In the crystal, mol-ecules are linked by N-H⋯O hydrogen bonds supported by C-H⋯O contacts into chains along the ab diagonal. The structure also features C-H⋯O hydrogen bonds, forming R 2 (2)(8) and R 2 (2)(16) rings and generating a three-dimensional array.

摘要

在标题化合物C22H20ClN3O4中,中心吡咯烷环在氮原子上呈信封式构象。吲哚啉酮体系各自大致呈平面状,吲哚啉酮单元的螺碳原子与其平均平面的最大偏差为0.130 Å,5-氯-1-甲基吲哚啉酮单元的羰基碳原子与其平均平面的最大偏差为0.172 Å。它们与穿过中心吡咯烷环的平均平面形成的二面角分别为77.7 (8)°和86.1 (8)°。在晶体中,分子通过N—H⋯O氢键连接,并由C—H⋯O接触支撑,沿ab对角线形成链状结构。该结构还具有C—H⋯O氢键,形成R 2 (2)(8)和R 2 (2)(16)环,并生成三维阵列。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/b8f2/3684914/d795bf379d93/e-69-0o825-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/b8f2/3684914/e6b6a429f352/e-69-0o825-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/b8f2/3684914/d795bf379d93/e-69-0o825-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/b8f2/3684914/e6b6a429f352/e-69-0o825-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/b8f2/3684914/d795bf379d93/e-69-0o825-fig2.jpg

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