• 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-羧甲基-2-乙基-4-甲基-1H-咪唑-3-鎓氯化物一水合物

1-Carboxy-methyl-2-ethyl-4-methyl-1H-imidazol-3-ium chloride monohydrate.

作者信息

Chen Chuan-Qing, Luo Shi-Neng, Lin Jian-Guo, Qiu Ling, Xia Yong-Mei

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2009 Apr 22;65(Pt 5):o1081. doi: 10.1107/S1600536809013403.

DOI:10.1107/S1600536809013403
PMID:21583896
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC2977760/
Abstract

In the title compound, C(8)H(13)N(2)O(2) (+)·Cl(-)·H(2)O, the methyl C atom of the ethyl group is slightly out of the imidazole plane, with an N-C(ring)-C-C torsion angle of -15.1 (2)°. In the crystal structure, there are strong inter-molecular hydrogen-bonding inter-actions between the solvent water mol-ecule, the free chloride anion and the organic cation, resulting in a two-dimensional supra-molecular network in the ab plane.

摘要

在标题化合物C₈H₁₃N₂O₂⁺·Cl⁻·H₂O中,乙基的甲基碳原子略微偏离咪唑平面,N-C(环)-C-C扭转角为-15.1 (2)°。在晶体结构中,溶剂水分子、游离氯离子阴离子与有机阳离子之间存在强烈的分子间氢键相互作用,在ab平面上形成二维超分子网络。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/ae32/2977760/f444a7529731/e-65-o1081-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/ae32/2977760/326f50b19a9a/e-65-o1081-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/ae32/2977760/f444a7529731/e-65-o1081-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/ae32/2977760/326f50b19a9a/e-65-o1081-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/ae32/2977760/f444a7529731/e-65-o1081-fig2.jpg

相似文献

1
1-Carboxy-methyl-2-ethyl-4-methyl-1H-imidazol-3-ium chloride monohydrate.1-羧甲基-2-乙基-4-甲基-1H-咪唑-3-鎓氯化物一水合物
Acta Crystallogr Sect E Struct Rep Online. 2009 Apr 22;65(Pt 5):o1081. doi: 10.1107/S1600536809013403.
2
1-Carboxymethyl-3-methyl-1H-imidazol-3-ium chloride 2-(3-methyl-1H-imidazol-3-ium-1-yl)acetate monohydrate: a crystal stabilized by imidazolium zwitterions.1-羧甲基-3-甲基-1H-咪唑-3-鎓氯化物 2-(3-甲基-1H-咪唑-3-鎓-1-基)乙酸酯一水合物:一种由咪唑两性离子稳定的晶体。
Acta Crystallogr C. 2013 Oct;69(Pt 10):1173-6. doi: 10.1107/S0108270113023676. Epub 2013 Sep 6.
3
4-[(2-Chloro-ethyl)amino]quinolinium chloride monohydrate.4-[(2-氯-乙基)氨基]喹啉氯化铵一水合物
Acta Crystallogr Sect E Struct Rep Online. 2009 Nov 21;65(Pt 12):o3120-1. doi: 10.1107/S160053680904834X.
4
4-Carb-oxy-2-methyl-1H-imidazol-3-ium-5-carboxyl-ate monohydrate.4-羧基-2-甲基-1H-咪唑-3-鎓-5-羧酸盐一水合物
Acta Crystallogr Sect E Struct Rep Online. 2008 Dec 6;65(Pt 1):o22. doi: 10.1107/S1600536808040221.
5
7-(2,2-Dimethylpropanamido)-2-methyl-1,8-naphthyridin-1-ium chloride monohydrate.7-(2,2-二甲基丙酰胺基)-2-甲基-1,8-萘啶鎓氯化物一水合物
Acta Crystallogr Sect E Struct Rep Online. 2009 Jan 17;65(Pt 2):o340. doi: 10.1107/S1600536808042955.
6
4-[(E)-2-(2,4-Dichloro-benzyl-idene)hydrazin-1-yl]quinolin-1-ium chloride monohydrate.4-[(E)-2-(2,4-二氯苄叉基)肼基-1-基]喹啉-1-鎓氯化物一水合物
Acta Crystallogr Sect E Struct Rep Online. 2012 Apr 1;68(Pt 4):o1232-3. doi: 10.1107/S1600536812012962. Epub 2012 Mar 31.
7
Dichlorido[bis-(2-ethyl-5-methyl-1H-imidazol-4-yl-κN)methane]-cobalt(II) monohydrate.一水合二氯[双-(2-乙基-5-甲基-1H-咪唑-4-基-κN)甲烷]钴(II)
Acta Crystallogr Sect E Struct Rep Online. 2011 May 1;67(Pt 5):m575. doi: 10.1107/S1600536811011032. Epub 2011 Apr 13.
8
4-Carbamoylpyridin-1-ium 2,2,2-tri-chloro-acetate-isonicotinamide (1/1).4-氨基甲酰吡啶-1-鎓 2,2,2-三氯乙酸异烟酰胺(1/1)
Acta Crystallogr Sect E Struct Rep Online. 2012 Sep 1;68(Pt 9):o2818. doi: 10.1107/S1600536812037002. Epub 2012 Aug 31.
9
Crystal structure and Hirshfeld surface analysis of 2,4-di-amino-6-methyl-1,3,5-triazin-1-ium tri-chloro-acetate monohydrate.2,4-二氨基-6-甲基-1,3,5-三嗪鎓三氯乙酸盐水合物的晶体结构与 Hirshfeld 表面分析
Acta Crystallogr E Crystallogr Commun. 2018 Jun 12;74(Pt 7):944-948. doi: 10.1107/S2056989018008307. eCollection 2018 Jul 1.
10
catena-Poly[2-methyl-1H-imidazol-3-ium [(aqua-chloridocadmate)-di-μ-chlorido]].链状聚[2-甲基-1H-咪唑-3-鎓[(水合氯化镉)-二-μ-氯]]
Acta Crystallogr Sect E Struct Rep Online. 2011 Nov;67(Pt 11):m1584. doi: 10.1107/S1600536811042905. Epub 2011 Oct 22.

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.
2
Patterns of pain in Paget's disease of bone and their outcomes on treatment with pamidronate.
Clin Rheumatol. 2003 Dec;22(6):376-80. doi: 10.1007/s10067-003-0762-x. Epub 2003 Oct 17.
3
Therapeutic benefit of bisphosphonates in the management of prostate cancer-related bone disease.
Expert Opin Pharmacother. 2003 May;4(5):705-16. doi: 10.1517/14656566.4.5.705.