Surface-enhanced Raman scattering and DFT computational studies of a benzotriazole derivative
文献类型：期刊论文
| 作者 | Li, Man-Yu3,4; Liao, Qing3,4; Zhang, Meng1,2; Ai, Xi-Cheng4; Li, Fu-You1,2 |
| 刊名 | JOURNAL OF MOLECULAR STRUCTURE
 |
| 出版日期 | 2008-10-15 |
| 卷号 | 888期号:1-3页码:2-6 |
| 关键词 | Benzotriazole Derivative Surface-enhanced Raman Scattering (Sers) Density Functional Theory (Dft) Adsorption Geometry Adsorptive Site |
| ISSN号 | 0022-2860 |
| DOI | 10.1016/j.molstruc.2007.11.019 |
| 英文摘要 | Here, we report the surface-enhanced Raman scattering (SERS) spectrum of 2-(2 '-hydroxy-5 '-methylphenyl)benzotriazole (Tinuvin P), a benzotriazole derivative that is the most widely used commercially available UV absorber or stabilizer and is used representatively for the research of photostability mechanism. A full assignment of the Raman spectrum has been made based on the scaled-DFT analysis of the normal vibrational modes. Through the comparative studies on the ordinary Raman spectrum and the SERS spectrum of Tinuvin P, we propose that this molecule binds the Au atom, via the O atom of the hydroxyl or the N1 atom of the benzotriazole moiety, with a perpendicular geometry. (C) 2007 Elsevier B.V. All rights reserved. |
| 语种 | 英语 |
| WOS记录号 | WOS:000260270200001 |
| 出版者 | ELSEVIER SCIENCE BV |
| 源URL | [http://ir.iccas.ac.cn/handle/121111/65021]  |
| 专题 | 中国科学院化学研究所 |
| 通讯作者 | Li, Fu-You |
| 作者单位 | 1.Fudan Univ, Dept Chem, Shanghai 200433, Peoples R China 2.Fudan Univ, Adv Mat Lab, Shanghai 200433, Peoples R China 3.Chinese Acad Sci, Inst Chem, State Key Lab Struct Chem Unstable & Stable Speci, BNLMS, Beijing 100080, Peoples R China 4.Renmin Univ China, Dept Chem, Beijing 100872, Peoples R China |
| 推荐引用方式 GB/T 7714 | Li, Man-Yu,Liao, Qing,Zhang, Meng,et al. Surface-enhanced Raman scattering and DFT computational studies of a benzotriazole derivative[J]. JOURNAL OF MOLECULAR STRUCTURE,2008,888(1-3):2-6. |
| APA | Li, Man-Yu,Liao, Qing,Zhang, Meng,Ai, Xi-Cheng,&Li, Fu-You.(2008).Surface-enhanced Raman scattering and DFT computational studies of a benzotriazole derivative.JOURNAL OF MOLECULAR STRUCTURE,888(1-3),2-6. |
| MLA | Li, Man-Yu,et al."Surface-enhanced Raman scattering and DFT computational studies of a benzotriazole derivative".JOURNAL OF MOLECULAR STRUCTURE 888.1-3(2008):2-6. |
入库方式： OAI收割
来源：化学研究所
浏览0
下载0
收藏0
其他版本
除非特别说明，本系统中所有内容都受版权保护，并保留所有权利。