• 文献检索
  • 文档翻译
  • 深度研究
  • 学术资讯
  • Suppr Zotero 插件Zotero 插件
  • 邀请有礼
  • 套餐&价格
  • 历史记录
应用&插件
Suppr Zotero 插件Zotero 插件浏览器插件Mac 客户端Windows 客户端微信小程序
定价
高级版会员购买积分包购买API积分包
服务
文献检索文档翻译深度研究API 文档MCP 服务
关于我们
关于 Suppr公司介绍联系我们用户协议隐私条款
关注我们

Suppr 超能文献

核心技术专利:CN118964589B侵权必究
粤ICP备2023148730 号-1Suppr @ 2026

文献检索

告别复杂PubMed语法,用中文像聊天一样搜索,搜遍4000万医学文献。AI智能推荐,让科研检索更轻松。

立即免费搜索

文件翻译

保留排版,准确专业,支持PDF/Word/PPT等文件格式,支持 12+语言互译。

免费翻译文档

深度研究

AI帮你快速写综述,25分钟生成高质量综述,智能提取关键信息,辅助科研写作。

立即免费体验

1-甲基-1'-(4-甲基苯基)-2',3',5',6',7',7a'-六氢-1'H-二螺[哌啶-3,2'-吡咯嗪-3',3''-吲哚啉]-4,2''-二酮

1-Methyl-1'-(4-methyl-phen-yl)-2',3',5',6',7',7a'-hexa-hydro-1'H-dispiro-[piperidine-3,2'-pyrrolizine-3',3''-indoline]-4,2''-dione.

作者信息

Ramaswamy S, Sribala R, Srinivasan N, Krishnakumar R V, Kumar R Ranjith

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2012 Sep 1;68(Pt 9):o2772-3. doi: 10.1107/S1600536812036240. Epub 2012 Aug 25.

DOI:10.1107/S1600536812036240
PMID:22969652
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC3435806/
Abstract

The title compound, C(26)H(29)N(3)O(2), crystallizes with two mol-ecules in the asymmetric unit, having C-H⋯O inter-actions between them and resulting in a dimer characterized by an R(2) (2)(11) motif. These dimers are linked into an ABABAB chain via N-H⋯O, N-H⋯N and C-H⋯O built edge-fused R(1) (2)(5) and R(2) (2)(7) motifs. This chain is linked to its inversion-related partner via N-H⋯O bonds with an R(2) (2)(8) motif and leads to a double chain extending along the b axis characterized by an R(6) (6)(36) motif across the inversion centres. The methyl group of the phenyl ring and the oxindole of mol-ecule A and B are involved in C-H⋯π inter-actions. One C atom of the pyrrolizine ring of mol-ecule A and its attached H atoms show positional disorder, the major and minor components being in the ratio 0.706 (7):0.294 (7).

摘要

标题化合物C(26)H(29)N(3)O(2)在不对称单元中以两个分子结晶,它们之间存在C-H⋯O相互作用,形成了一个以R(2) (2)(11)基序为特征的二聚体。这些二聚体通过N-H⋯O、N-H⋯N和C-H⋯O形成的边缘稠合R(1) (2)(5)和R(2) (2)(7)基序连接成ABABAB链。该链通过具有R(2) (2)(8)基序的N-H⋯O键与其反演相关的伙伴相连,形成沿b轴延伸的双链,其特征是通过反演中心的R(6) (6)(36)基序。分子A和B的苯环甲基和羟吲哚参与C-H⋯π相互作用。分子A的吡咯嗪环的一个C原子及其连接的H原子表现出位置无序,主要和次要组分的比例为0.706 (7):0.294 (7)。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/cd4a/3435806/3c9a27c6e1e4/e-68-o2772-fig3.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/cd4a/3435806/4a30b78a37a6/e-68-o2772-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/cd4a/3435806/eb0c00e63d2b/e-68-o2772-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/cd4a/3435806/3c9a27c6e1e4/e-68-o2772-fig3.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/cd4a/3435806/4a30b78a37a6/e-68-o2772-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/cd4a/3435806/eb0c00e63d2b/e-68-o2772-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/cd4a/3435806/3c9a27c6e1e4/e-68-o2772-fig3.jpg

相似文献

1
1-Methyl-1'-(4-methyl-phen-yl)-2',3',5',6',7',7a'-hexa-hydro-1'H-dispiro-[piperidine-3,2'-pyrrolizine-3',3''-indoline]-4,2''-dione.1-甲基-1'-(4-甲基苯基)-2',3',5',6',7',7a'-六氢-1'H-二螺[哌啶-3,2'-吡咯嗪-3',3''-吲哚啉]-4,2''-二酮
Acta Crystallogr Sect E Struct Rep Online. 2012 Sep 1;68(Pt 9):o2772-3. doi: 10.1107/S1600536812036240. Epub 2012 Aug 25.
2
1'-(1,3-Diphenyl-1H-pyrazol-4-yl)-1''-(prop-2-en-1-yl)-2',3',5',6',7',7a'-hexa-hydro-1'H-di-spiro-[1-benzo-pyran-3,2'-pyrrolizine-3',3''-indoline]-2'',4-dione 0.75-hydrate.1'-(1,3-二苯基-1H-吡唑-4-基)-1''-(2-丙烯-1-基)-2',3',5',6',7',7a'-六氢-1'H-二螺-[1-苯并吡喃-3,2'-吡咯嗪-3',3''-吲哚啉]-2'',4-二酮0.75水合物
Acta Crystallogr Sect E Struct Rep Online. 2013 Jul 3;69(Pt 8):o1194-5. doi: 10.1107/S160053681301773X. eCollection 2013.
3
Crystal structure of 7'-(4-chloro-phen-yl)-2''-(4-meth-oxy-phen-yl)-7',7a',7'',8''-tetra-hydro-1',3',5''-di-spiro-[indoline-3,5'-pyrrolo-[1,2-]thia-zole-6',6''-quinoline]-2,5''-dione and an unknown solvent.7'-(4-氯苯基)-2''-(4-甲氧基苯基)-7',7a',7'',8''-四氢-1',3',5''-二螺-[吲哚啉-3,5'-吡咯并-[1,2-]噻唑-6',6''-喹啉]-2,5''-二酮与一种未知溶剂的晶体结构
Acta Crystallogr E Crystallogr Commun. 2019 Jan 11;75(Pt 2):189-193. doi: 10.1107/S2056989019000112. eCollection 2019 Feb 1.
4
1'-(2-Chloro-phen-yl)-5,6,5',6',7',7a'-hexa-hydro-1'H,1''H-dispiro-[imidazo[2,1-b][1,3]thia-zole-2,2'-pyrrolizine-3'(2'H),3''-indole]-2'',3(2H,3''H)-dione.1 '-(2-氯苯基)-5,6,5',6',7',7a'-六氢-1'H,1''H-二螺-[咪唑并[2,1-b][1,3]噻唑-2,2'-吡咯嗪-3'(2'H),3''-吲哚]-2'',3(2H,3''H)-二酮
Acta Crystallogr Sect E Struct Rep Online. 2010 Mar 17;66(Pt 4):o852. doi: 10.1107/S1600536810009323.
5
1'-(1,3-Diphenyl-1H-pyrazol-4-yl)-1''-methyl-2',3',5',6',7',7a'-octa-hydro-1'H-dispiro-[1-benzopyran-3,2'-pyrrolizine-3',3''-indoline]-2'',4-dione.1'-(1,3-二苯基-1H-吡唑-4-基)-1''-甲基-2',3',5',6',7',7a'-八氢-1'H-二螺-[1-苯并吡喃-3,2'-吡咯嗪-3',3''-吲哚]-2'',4-二酮
Acta Crystallogr Sect E Struct Rep Online. 2013 Mar 1;69(Pt 3):o317. doi: 10.1107/S1600536813002043. Epub 2013 Feb 2.
6
Ethyl 1''-benzyl-2''-oxo-2',3',5',6',7',7a'-hexa-hydro-1'H-di-spiro-[indeno-[1,2-b]quinoxaline-11,2'-pyrrolizine-3',3''-indoline]-1'-carboxyl-ate monohydrate.1''-苄基-2''-氧代-2',3',5',6',7',7a'-六氢-1'H-二螺-[茚并-[1,2-b]喹喔啉-11,2'-吡咯嗪-3',3''-吲哚啉]-1'-羧酸乙酯一水合物
Acta Crystallogr Sect E Struct Rep Online. 2013 May 11;69(Pt 6):o854-5. doi: 10.1107/S1600536813011537. Print 2013 Jun 1.
7
5''-(4-Nitro-benzyl-idene)-7'-(4-nitro-phen-yl)-1''-methyl-1',3',5',6',7',7a'-hexa-hydro-dispiro-[ace-naphthyl-ene-1,5'-pyrrolo-[1,2-c][1,3]thia-zole-6',3''-piperidine]-2,4''(1H)-dione including an unknown solvate.5''-(4-硝基-亚苄基)-7'-(4-硝基-苯基)-1''-甲基-1',3',5',6',7',7a'-六氢-二螺-[苊烯-1,5'-吡咯并-[1,2-c][1,3]噻唑-6',3''-哌啶]-2,4''(1H)-二酮,含一种未知溶剂化物
Acta Crystallogr Sect E Struct Rep Online. 2013 Jul 6;69(Pt 8):o1208-9. doi: 10.1107/S1600536813017704. eCollection 2013.
8
1'-(1,3-Diphenyl-1H-pyrazol-4-yl)-2',3',5',6',7',7a'-hexa-hydro-1'H-di-spiro-[ace-naphthyl-ene-1,3'-pyrrolizine-2',3''-chromane]-2,4''(1H)-dione.
Acta Crystallogr Sect E Struct Rep Online. 2013 Apr 13;69(Pt 5):o711. doi: 10.1107/S1600536813009562. Print 2013 May 1.
9
1-[2-Oxo-1'-phenyl-2',3',5',6',7',7a'-hexa-hydroindoline-3-spiro-3'-1'H-pyrrolizin-2'-yl]-3-phenyl-prop-2-en-1-one.1-[2-氧代-1'-苯基-2',3',5',6',7',7a'-六氢吲哚啉-3-螺-3'-1'H-吡咯嗪-2'-基]-3-苯基-2-丙烯-1-酮
Acta Crystallogr Sect E Struct Rep Online. 2008 Aug 23;64(Pt 9):o1817. doi: 10.1107/S1600536808024781.
10
(6'R*,7'R*)-7'-(1,3,-Diphenyl-1H-pyrazol-4-yl)-1,2,5',6',7',7a',3'',4''-octa-hydro-1'H,2''H-dispiro-[acenaphthyl-ene-1,5'-pyrrolo-[1,2-c][1,3]thia-zole-6',3''-[1]benzopyran]-2,4''-dione.(6'R*,7'R*)-7'-(1,3-二苯基-1H-吡唑-4-基)-1,2,5',6',7',7a',3'',4''-八氢-1'H,2''H-二螺-[苊烯-1,5'-吡咯并-[1,2-c][1,3]噻唑-6',3''-[1]苯并吡喃]-2,4''-二酮
Acta Crystallogr Sect E Struct Rep Online. 2013 Mar 6;69(Pt 4):o493-4. doi: 10.1107/S1600536813005825. Print 2013 Apr 1.

本文引用的文献

1
Structure validation in chemical crystallography.化学晶体学中的结构验证
Acta Crystallogr D Biol Crystallogr. 2009 Feb;65(Pt 2):148-55. doi: 10.1107/S090744490804362X. Epub 2009 Jan 20.
2
A short history of SHELX.SHELX简史。
Acta Crystallogr A. 2008 Jan;64(Pt 1):112-22. doi: 10.1107/S0108767307043930. Epub 2007 Dec 21.