• 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-（2-萘基）-3-苯基-3-（4,5,6,7-四氢-1,2,3-苯并硒二唑-4-基）丙-1-酮

1-(2-Naphth-yl)-3-phenyl-3-(4,5,6,7-tetra-hydro-1,2,3-benzoselenadiazol-4-yl)propan-1-one.

作者信息

Muthukumaran J, Nachiappan M, Chitra S, Manisankar P, Bhattacharya Suman, Muthusubramanian S, Krishna R, Jeyakanthan J

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2011 Aug 1;67(Pt 8):o2010-1. doi: 10.1107/S1600536811027103. Epub 2011 Jul 13.

DOI:10.1107/S1600536811027103
PMID:22091044
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC3213465/
Abstract

In the title compound, C(25)H(22)N(2)OSe, the fused six-membered cyclo-hexene ring of the 4,5,6,7-tetra-hydro-1,2,3-benzoselenadiazole group adopts a near half-chair conformation and the five-membered 1,2,3-selenadiazole ring is essentially planar (r.m.s. deviation = 0.004 Å). There are weak inter-molecular C-H⋯O and C-H⋯π inter-actions in the crystal structure. Inter-molecular π-π stacking is also observed between the naphthyl units, with a centroid-centroid distance of 3.529 (15) Å.

摘要

在标题化合物C₂₅H₂₂N₂OSe中，4,5,6,7-四氢-1,2,3-苯并硒二唑基团的稠合六元环己烯环呈近半椅构象，五元1,2,3-硒二唑环基本为平面结构（均方根偏差 = 0.004 Å）。晶体结构中存在弱的分子间C-H⋯O和C-H⋯π相互作用。在萘基单元之间也观察到分子间π-π堆积，质心间距为3.529 (15) Å。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/90ea/3213465/f50e446c751a/e-67-o2010-fig3.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/90ea/3213465/67bfe2e6dc3a/e-67-o2010-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/90ea/3213465/7754a0b1cc2d/e-67-o2010-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/90ea/3213465/f50e446c751a/e-67-o2010-fig3.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/90ea/3213465/67bfe2e6dc3a/e-67-o2010-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/90ea/3213465/7754a0b1cc2d/e-67-o2010-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/90ea/3213465/f50e446c751a/e-67-o2010-fig3.jpg

相似文献

1
1-(2-Naphth-yl)-3-phenyl-3-(4,5,6,7-tetra-hydro-1,2,3-benzoselenadiazol-4-yl)propan-1-one.1-（2-萘基）-3-苯基-3-（4,5,6,7-四氢-1,2,3-苯并硒二唑-4-基）丙-1-酮
Acta Crystallogr Sect E Struct Rep Online. 2011 Aug 1;67(Pt 8):o2010-1. doi: 10.1107/S1600536811027103. Epub 2011 Jul 13.
2
3-(4-Methyl-phen-yl)-1-phenyl-3-(4,5,6,7-tetra-hydro-1,2,3-benzoselenadiazol-4-yl)propan-1-one.3-（4-甲基苯基）-1-苯基-3-（4,5,6,7-四氢-1,2,3-苯并硒二唑-4-基）丙-1-酮
Acta Crystallogr Sect E Struct Rep Online. 2011 Jul 1;67(Pt 7):o1660-1. doi: 10.1107/S160053681102174X. Epub 2011 Jun 18.
3
4a-Hy-droxy-9-(2-meth-oxy-phen-yl)-4,4a,5,6,7,8,9,9a-octa-hydro-3H-xanthene-1,8(2H)-dione.4a-羟基-9-(2-甲氧基苯基)-4,4a,5,6,7,8,9,9a-八氢-3H-占吨-1,8(2H)-二酮
Acta Crystallogr Sect E Struct Rep Online. 2010 Dec 4;67(Pt 1):o35-6. doi: 10.1107/S1600536810050191.
4
Crystal structure of N-(3-benzoyl-4,5,6,7-tetra-hydro-1-benzo-thio-phen-2-yl)benzamide.N-（3-苯甲酰基-4,5,6,7-四氢-1-苯并噻吩-2-基）苯甲酰胺的晶体结构
Acta Crystallogr Sect E Struct Rep Online. 2014 Aug 1;70(Pt 9):o951-2. doi: 10.1107/S1600536814016948. eCollection 2014 Sep 1.
5
1'-Methyl-4'-(1-naphth-yl)-1'',2'',3'',4''-tetra-hydro-indane-2-spiro-2'-pyrrolidine-3'-spiro-2''-naphthalene-1,3,1''-trione.1'-甲基-4'-(1-萘基)-1'',2'',3'',4''-四氢茚-2-螺-2'-吡咯烷-3'-螺-2''-萘-1,3,1''-三酮
Acta Crystallogr Sect E Struct Rep Online. 2011 Feb 12;67(Pt 3):o629. doi: 10.1107/S1600536811004880.
6
Crystal structure of 2-benzyl-amino-4-(4-meth-oxy-phen-yl)-6,7,8,9-tetra-hydro-5H-cyclo-hepta-[b]pyridine-3-carbo-nitrile.2-苄基氨基-4-（4-甲氧基苯基）-6,7,8,9-四氢-5H-环庚并[b]吡啶-3-甲腈的晶体结构
Acta Crystallogr Sect E Struct Rep Online. 2014 Nov 19;70(Pt 12):525-7. doi: 10.1107/S1600536814024878. eCollection 2014 Dec 1.
7
2-Phenyl-8,9,10,11-tetra-hydro-1-benzo-thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine.2-苯基-8,9,10,11-四氢-1-苯并噻吩并[3,2-e][1,2,4]三唑并[1,5-c]嘧啶
Acta Crystallogr Sect E Struct Rep Online. 2011 Apr 1;67(Pt 4):o777-8. doi: 10.1107/S1600536811007331. Epub 2011 Mar 5.
8
1'-Methyl-4'-(1-naphth-yl)-3''-(1-naphthyl-methyl-ene)acenaphthene-1-spiro-2'-pyrrolidine-3'-spiro-1''-cyclo-hexane-2,2''-dione.1'-甲基-4'-(1-萘基)-3''-(1-萘基亚甲基)苊-1-螺-2'-吡咯烷-3'-螺-1''-环己烷-2,2''-二酮
Acta Crystallogr Sect E Struct Rep Online. 2007 Dec 6;64(Pt 1):o95-6. doi: 10.1107/S1600536807061387.
9
Ethyl 3,6-dihy-droxy-6-methyl-4-phenyl-4,5,6,7-tetra-hydro-1H-indazole-5-carboxyl-ate monohydrate.3,6-二羟基-6-甲基-4-苯基-4,5,6,7-四氢-1H-吲唑-5-羧酸乙酯一水合物
Acta Crystallogr Sect E Struct Rep Online. 2011 Jan 22;67(Pt 2):o480. doi: 10.1107/S160053681100242X.
10
4-{(4-Chloro-phen-yl)[4-(4-methyl-phen-yl)-1,2,3-selenadiazol-5-yl]meth-yl}-4,5,6,7-tetra-hydro-1,2,3-benzoselenadiazole.4 - {（4 - 氯苯基）[4 - （4 - 甲基苯基）- 1,2,3 - 硒二唑 - 5 - 基]甲基}- 4,5,6,7 - 四氢 - 1,2,3 - 苯并硒二唑
Acta Crystallogr Sect E Struct Rep Online. 2011 Jun 1;67(Pt 6):o1421-2. doi: 10.1107/S160053681101751X. Epub 2011 May 14.

引用本文的文献

1
Ethyl 3-(4-chloro-phen-yl)-2-phenyl-3-(4-phenyl-1,2,3-selena-diazol-5-yl)propano-ate.3-(4-氯苯基)-2-苯基-3-(4-苯基-1,2,3-硒二唑-5-基)丙酸乙酯
Acta Crystallogr Sect E Struct Rep Online. 2013 Jul 10;69(Pt 8):o1239. doi: 10.1107/S1600536813017790. eCollection 2013.

本文引用的文献

1
Synthesis and in vitro anticancer activities of some selenadiazole derivatives.合成及一些硒杂氮杂卓衍生物的体外抗癌活性。
Arch Pharm (Weinheim). 2010 Nov;343(11-12):680-91. doi: 10.1002/ardp.201000014.
2
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.
3
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.
4
The Michael reaction catalyzed by KF/basic alumina under ultrasound irradiation.在超声辐射下由KF/碱性氧化铝催化的迈克尔反应。
Ultrason Sonochem. 2003 Mar;10(2):115-8. doi: 10.1016/s1350-4177(02)00134-7.
5
Synthesis and biological activity of some azoles and azines.某些唑类和嗪类化合物的合成及其生物活性
Pharmazie. 1990 Oct;45(10):791-2.