• 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

2,5-双-[(二苯氧基磷酰基)-氧基]环己-1,4-二烯-1,4-二甲酸二甲酯的晶体结构

Crystal structure of dimethyl 2,5-bis-[(di-phen-oxy-phosphor-yl)-oxy]cyclo-hexa-1,4-diene-1,4-di-carboxyl-ate.

作者信息

Gao Lei, Ma Zongshan, Yan Hong

机构信息

College of Life Science and Bio-engineering, Beijing University of Technology, Pingleyuan Street No. 100, Chaoyang District, Beijing 100124, People's Republic of China.

出版信息

Acta Crystallogr E Crystallogr Commun. 2015 May 13;71(Pt 6):o401-2. doi: 10.1107/S2056989015008658. eCollection 2015 Jun 1.

DOI:10.1107/S2056989015008658
PMID:26090189
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC4459327/
Abstract

In the title compound, C34H30O12P2, which was synthesized via the esterification of dimethyl 2,5-dioxo-1,4-cyclo-hexa-nedi-carboxyl-ate with diphenyl chloro-phosphate, the mol-ecule has crystallographic inversion symmetry. The dihedral angles between the plane of the cyclo-hexa-1,4-diene ring and those of the two benzene rings of the substituent phosphate groups are 41.0 (1) and 89.5 (1)°, while that with the ester group is 3.1 (3)°. In the crystal, only weak inter-molecular C-H⋯O hydrogen bonds are present.

摘要

在标题化合物C₃₄H₃₀O₁₂P₂中，其通过2,5 - 二氧代 - 1,4 - 环己烷二甲酸二甲酯与氯代磷酸二苯酯的酯化反应合成，分子具有晶体学反演对称性。环己 - 1,4 - 二烯环平面与取代磷酸基团的两个苯环平面之间的二面角分别为41.0 (1)°和89.5 (1)°，而与酯基的二面角为3.1 (3)°。在晶体中，仅存在弱的分子间C - H⋯O氢键。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/3076/4459327/2d4ff0daea6d/e-71-0o401-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/3076/4459327/6e4432b50919/e-71-0o401-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/3076/4459327/2d4ff0daea6d/e-71-0o401-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/3076/4459327/6e4432b50919/e-71-0o401-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/3076/4459327/2d4ff0daea6d/e-71-0o401-fig2.jpg

相似文献

1
Crystal structure of dimethyl 2,5-bis-[(di-phen-oxy-phosphor-yl)-oxy]cyclo-hexa-1,4-diene-1,4-di-carboxyl-ate.2,5-双-[(二苯氧基磷酰基)-氧基]环己-1,4-二烯-1,4-二甲酸二甲酯的晶体结构
Acta Crystallogr E Crystallogr Commun. 2015 May 13;71(Pt 6):o401-2. doi: 10.1107/S2056989015008658. eCollection 2015 Jun 1.
2
Crystal structures of three 1-oxo-1,2-di-hydro-naphthalene derivatives: dimethyl 4-(4-meth-oxy-phen-yl)-2-(4-methyl-phen-yl)-1-oxo-1,2-di-hydro-naphthalene-2,3-di-carboxyl-ate, dimethyl 1-oxo-2-(pyren-4-yl)-4-(thio-phen-2-yl)-1,2-di-hydro-naphthalene-2,3-di-carboxyl-ate and ethyl 1-oxo-2-phenyl-2,4-bis-(thio-phen-2-yl)-1,2-di-hydro-naphthalene-3-carboxyl-ate.三种1-氧代-1,2-二氢萘衍生物的晶体结构：4-(4-甲氧基苯基)-2-(4-甲基苯基)-1-氧代-1,2-二氢萘-2,3-二羧酸二甲酯、1-氧代-2-(芘-4-基)-4-(噻吩-2-基)-1,2-二氢萘-2,3-二羧酸二甲酯和1-氧代-2-苯基-2,4-双(噻吩-2-基)-1,2-二氢萘-3-羧酸乙酯。
Acta Crystallogr E Crystallogr Commun. 2017 Jan 13;73(Pt 2):177-182. doi: 10.1107/S2056989017000469. eCollection 2017 Feb 1.
3
Ethyl 2-amino-4,6-bis-(4-fluoro-phen-yl)cyclo-hexa-1,3-diene-1-carboxyl-ate.2-氨基-4,6-双（4-氟苯基）环己-1,3-二烯-1-羧酸乙酯
Acta Crystallogr Sect E Struct Rep Online. 2012 Mar 1;68(Pt 3):o585. doi: 10.1107/S160053681200373X. Epub 2012 Feb 4.
4
Ethyl 2-amino-6-(4-bromo-phen-yl)-4-(4-fluoro-phen-yl)cyclo-hexa-1,3-diene-1-carboxyl-ate.2-氨基-6-(4-溴苯基)-4-(4-氟苯基)环己-1,3-二烯-1-羧酸乙酯
Acta Crystallogr Sect E Struct Rep Online. 2013 Aug 23;69(Pt 9):o1473. doi: 10.1107/S1600536813023325. eCollection 2013.
5
Crystal structure of dimethyl 3,4,5,6-tetra-phenyl-cyclo-hexa-3,5-diene-1,2-di-carboxyl-ate.3,4,5,6-四苯基环己-3,5-二烯-1,2-二甲酸二甲酯的晶体结构
Acta Crystallogr E Crystallogr Commun. 2016 Jun 14;72(Pt 7):947-50. doi: 10.1107/S2056989016009403. eCollection 2016 Jul 1.
6
An ortho-rhom-bic polymorph of N (1),N (4)-diphenyl-3,6-bis-(phenyl-imino)-cyclo-hexa-1,4-diene-1,4-di-amine.N(1),N(4)-二苯基-3,6-双（苯基亚氨基）-环己-1,4-二烯-1,4-二胺的一种正交晶型多晶型物。
Acta Crystallogr Sect E Struct Rep Online. 2014 Mar 29;70(Pt 4):o495-6. doi: 10.1107/S1600536814006254. eCollection 2014 Apr 1.
7
Crystal structure of fenpropathrin.甲氰菊酯的晶体结构。
Acta Crystallogr Sect E Struct Rep Online. 2014 Nov 19;70(Pt 12):o1265. doi: 10.1107/S160053681402474X. eCollection 2014 Dec 1.
8
Crystal structure of 10-benzyl-9-(3,4-di-meth-oxy-phen-yl)-3,3,6,6-tetra-methyl-3,4,6,7,9,10-hexa-hydro-acridine-1,8(2H,5H)-dione.10-苄基-9-(3,4-二甲氧基苯基)-3,3,6,6-四甲基-3,4,6,7,9,10-六氢吖啶-1,8(2H,5H)-二酮的晶体结构
Acta Crystallogr E Crystallogr Commun. 2015 Aug 26;71(Pt 9):o688-9. doi: 10.1107/S2056989015014966. eCollection 2015 Sep 1.
9
Crystal structure of diethyl 3-(3-chloro-phen-yl)-2,2-di-cyano-cyclo-propane-1,1-di-carboxyl-ate.3-(3-氯苯基)-2,2-二氰基环丙烷-1,1-二羧酸二乙酯的晶体结构
Acta Crystallogr E Crystallogr Commun. 2016 Jan 27;72(Pt 2):253-6. doi: 10.1107/S2056989016001444. eCollection 2016 Feb 1.
10
Methyl 12-hydroxy-10-[1-(4-meth-oxy-phen-yl)-2-oxo-3-phen-oxy-azetidin-4-yl]-11-oxa-3-aza-hexa-cyclo-[11.7.1.0(2,9).0(2,12).0(3,7).0(17,21)]henicosa-1(20),13,15,17(21),18-penta-ene-9-carboxyl-ate.12-羟基-10-[1-(4-甲氧基苯基)-2-氧代-3-苯氧基氮杂环丁烷-4-基]-11-氧杂-3-氮杂二十六环-[11.7.1.0(2,9).0(2,12).0(3,7).0(17,21)]二十一碳-1(20),13,15,17(21),18-五烯-9-羧酸甲酯
Acta Crystallogr Sect E Struct Rep Online. 2012 Dec 1;68(Pt 12):o3329-30. doi: 10.1107/S1600536812045795. Epub 2012 Nov 10.

本文引用的文献

1
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.