• 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-苯基-1H-1,2,3-三唑-4-基）甲基吡啶-3-羧酸酯

(1-Phenyl-1H-1,2,3-triazol-4-yl)methyl pyridine-3-carboxyl-ate.

作者信息

Karimov Zakirjon, Abdugafurov Ibrakhim, Talipov Samat, Tashkhodjaev Bakhodir

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2010 Jun 16;66(Pt 7):o1674. doi: 10.1107/S1600536810021999.

DOI:10.1107/S1600536810021999
PMID:21587899
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC3007003/
Abstract

In the title compound, C(15)H(12)N(4)O(2), the dihedral angle between the planes of the nicotino-yloxy fragment and triazole ring is 88.61 (5)°. The dihedral angle between the planes of triazole and benzene rings is 16.54 (11)°. The crystal structure is stabilized by inter-molecular C-H⋯N, C-H⋯O and C-H⋯π(triazole) hydrogen bonds and aromatic π-π stacking inter-actions between the benzene and triazole rings [centroid-centroid distance = 3.895 (1) Å].

摘要

在标题化合物C(15)H(12)N(4)O(2)中，烟酰氧基片段平面与三唑环平面之间的二面角为88.61 (5)°。三唑环平面与苯环平面之间的二面角为16.54 (11)°。晶体结构通过分子间C-H⋯N、C-H⋯O和C-H⋯π（三唑）氢键以及苯环与三唑环之间的芳香π-π堆积相互作用得以稳定[质心-质心距离 = 3.895 (1) Å]。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/fbe6/3007003/d52508641970/e-66-o1674-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/fbe6/3007003/350b9bd8b036/e-66-o1674-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/fbe6/3007003/d52508641970/e-66-o1674-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/fbe6/3007003/350b9bd8b036/e-66-o1674-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/fbe6/3007003/d52508641970/e-66-o1674-fig2.jpg

相似文献

1
(1-Phenyl-1H-1,2,3-triazol-4-yl)methyl pyridine-3-carboxyl-ate.（1-苯基-1H-1,2,3-三唑-4-基）甲基吡啶-3-羧酸酯
Acta Crystallogr Sect E Struct Rep Online. 2010 Jun 16;66(Pt 7):o1674. doi: 10.1107/S1600536810021999.
2
Ethyl 4-{[1-(2,4-dichloro-benz-yl)-1H-1,2,3-triazol-4-yl]meth-oxy}-8-(trifluoro-meth-yl)quinoline-3-carboxyl-ate.4-{[1-(2,4-二氯苄基)-1H-1,2,3-三唑-4-基]甲氧基}-8-(三氟甲基)喹啉-3-羧酸乙酯
Acta Crystallogr Sect E Struct Rep Online. 2012 Oct 1;68(Pt 10):o3017-8. doi: 10.1107/S1600536812039633. Epub 2012 Sep 26.
3
5-(3-Methoxy-pheneth-yl)-4-(2-methoxy-phen-yl)-4H-1,2,4-triazol-3-ol.5-（3-甲氧基-苯乙基）-4-（2-甲氧基-苯基）-4H-1,2,4-三唑-3-醇
Acta Crystallogr Sect E Struct Rep Online. 2008 Oct 25;64(Pt 11):o2180. doi: 10.1107/S1600536808033990.
4
Crystal structure of 5-(5-chloro-2-hydroxy-benzo-yl)-2-(2-methyl-1H-indol-3-yl)nicotino-nitrile.5-(5-氯-2-羟基苯甲酰基)-2-(2-甲基-1H-吲哚-3-基)烟腈的晶体结构
Acta Crystallogr E Crystallogr Commun. 2015 Oct 7;71(Pt 11):o822-3. doi: 10.1107/S2056989015018058. eCollection 2015 Nov 1.
5
1-Phenyl-2-(1H-1,2,4-triazol-1-yl)ethanone.1-苯基-2-（1H-1,2,4-三唑-1-基）乙酮
Acta Crystallogr Sect E Struct Rep Online. 2008 Jul 26;64(Pt 8):o1604. doi: 10.1107/S1600536808023258.
6
N-[(4-Amino-5-sulfanyl-idene-4,5-dihydro-1H-1,2,4-triazol-3-yl)meth-yl]-4-methyl-benzamide.N-[(4-氨基-5-硫代亚基-4,5-二氢-1H-1,2,4-三唑-3-基)甲基]-4-甲基苯甲酰胺
Acta Crystallogr Sect E Struct Rep Online. 2010 Sep 4;66(Pt 10):o2501-2. doi: 10.1107/S1600536810035014.
7
1-[4-(Difluoro-meth-oxy)phen-yl]-N-(3,4-dimeth-oxy-phen-yl)-1H-1,2,4-triazole-3-carboxamide.1-[4-(二氟甲氧基)苯基]-N-(3,4-二甲氧基苯基)-1H-1,2,4-三唑-3-甲酰胺
Acta Crystallogr Sect E Struct Rep Online. 2010 Aug 11;66(Pt 9):o2267-8. doi: 10.1107/S1600536810029661.
8
4-Benzyl-1-(4-nitro-phen-yl)-1-1,2,3-triazole: crystal structure and Hirshfeld analysis.4-苄基-1-(4-硝基苯基)-1H-1,2,3-三唑：晶体结构与 Hirshfeld 分析
Acta Crystallogr E Crystallogr Commun. 2017 Oct 20;73(Pt 11):1716-1720. doi: 10.1107/S2056989017014748. eCollection 2017 Nov 1.
9
{4-[(2,4-Dichloro-benzo-yloxy)meth-yl]-1-phenyl-1H-1,2,3-triazol-5-yl}methyl 2,4-dichloro-benzoate.2,4-二氯苯甲酸{4-[(2,4-二氯苯氧基)甲基]-1-苯基-1H-1,2,3-三唑-5-基}甲酯
Acta Crystallogr Sect E Struct Rep Online. 2011 Oct 1;67(Pt 10):o2590. doi: 10.1107/S1600536811035550. Epub 2011 Sep 14.
10
Ethyl 5-methyl-1-(4-nitro-phen-yl)-1H-1,2,3-triazole-4-carboxyl-ate.5-甲基-1-(4-硝基苯基)-1H-1,2,3-三唑-4-羧酸乙酯
Acta Crystallogr Sect E Struct Rep Online. 2011 Sep 1;67(Pt 9):o2416. doi: 10.1107/S1600536811033940. Epub 2011 Aug 27.

引用本文的文献

1
Fully recoverable rigid shape memory foam based on copper-catalyzed azide-alkyne cycloaddition (CuAAC) using a salt leaching technique.基于铜催化叠氮化物-炔烃环加成反应（CuAAC）并采用盐浸技术的完全可恢复刚性形状记忆泡沫。
Polym Chem. 2018 Jan 7;9(1):121-130. doi: 10.1039/c7py01121k. Epub 2017 Nov 29.
2
Thermomechanical Formation-Structure-Property Relationships in Photopolymerized Copper-Catalyzed Azide-Alkyne (CuAAC) Networks.光聚合铜催化叠氮化物-炔烃（CuAAC）网络中的热机械形成-结构-性能关系
Macromolecules. 2016 Feb 23;49(4):1191-1200. doi: 10.1021/acs.macromol.6b00137. Epub 2016 Feb 2.

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
Halomethyl-1,2,3-triazole derivatives: a new type of alkylating agent active in mouse transplantable tumors.卤甲基-1,2,3-三唑衍生物：一种对小鼠可移植肿瘤具有活性的新型烷化剂。
Cancer Chemother Pharmacol. 1978;1(4):243-7. doi: 10.1007/BF00257157.