• 综合
  • 标题
  • 关键词
  • 摘要
  • 学者
  • 期刊-刊名
  • 期刊-ISSN
  • 会议名称
搜索

作者:

Song, Xiu-qing (Song, Xiu-qing.) | Tan, Hong-bo (Tan, Hong-bo.) | Yan, Hong (Yan, Hong.) (学者:闫红) | Chang, Yu (Chang, Yu.) (学者:常宇)

收录:

EI Scopus SCIE

摘要:

N,N-diacyl-1,4-dihydropyrazine derivatives (1) were prepared via an efficient microwave-assisted synthesis. 1 was isolated and unambiguously confirmed by NMR spectra and high-resolution mass spectrometry. The NMR spectra of 1 showed complicated rather than conventional spectroscopy. Variable temperature experiments and DFT calculation (PES) were used to investigate this phenomenon. DFT calculations confirmed that the structures of the two rotamers of I correspond to those determined by NMR in solution, and gave the syn-anti interconversion barriers of rotamers. The results showed that two isomers exist in solution (deuterated solvent) at room temperature, resulting in complicated NMR spectra. (C) 2017 Elsevier B.V. All rights reserved.

关键词:

1,4-Dihydropyrazine Conformational isomerism Density-functional theory (DFT) Microwave-assisted synthesis Variable-temperature NMR

作者机构:

  • [ 1 ] [Song, Xiu-qing]Beijing Univ Technol, Coll Life Sci & Bioengn, Beijing 100124, Peoples R China
  • [ 2 ] [Tan, Hong-bo]Beijing Univ Technol, Coll Life Sci & Bioengn, Beijing 100124, Peoples R China
  • [ 3 ] [Yan, Hong]Beijing Univ Technol, Coll Life Sci & Bioengn, Beijing 100124, Peoples R China
  • [ 4 ] [Chang, Yu]Beijing Univ Technol, Coll Life Sci & Bioengn, Beijing 100124, Peoples R China

通讯作者信息:

  • 闫红

    [Yan, Hong]Beijing Univ Technol, Coll Life Sci & Bioengn, Beijing 100124, Peoples R China

电子邮件地址:

查看成果更多字段

相关关键词:

来源 :

JOURNAL OF MOLECULAR STRUCTURE

ISSN: 0022-2860

年份: 2017

卷: 1134

页码: 606-610

3 . 8 0 0

JCR@2022

ESI学科: CHEMISTRY;

ESI高被引阀值:127

中科院分区:4

被引次数:

WoS核心集被引频次: 2

SCOPUS被引频次: 1

ESI高被引论文在榜: 0 展开所有

万方被引频次:

中文被引频次:

近30日浏览量: 3

在线人数/总访问数:1111/2920092
地址:北京工业大学图书馆(北京市朝阳区平乐园100号 邮编:100124) 联系我们:010-67392185
版权所有:北京工业大学图书馆 站点建设与维护:北京爱琴海乐之技术有限公司