Citation: YANG Fan, YU Peng-Yun, ZHAO Juan, ZHAO Yan, WANG Jian-Ping. Intermolecular Hydrogen Bonding Structural Dynamics in Ethylene Glycol by Femtosecond Nonlinear Infrared Spectroscopy[J]. Acta Physico-Chimica Sinica, ;2015, 31(7): 1275-1282. doi: 10.3866/PKU.WHXB201504211 shu

Intermolecular Hydrogen Bonding Structural Dynamics in Ethylene Glycol by Femtosecond Nonlinear Infrared Spectroscopy

YANG Fan ¹ ,
YU Peng-Yun ^1,2 ,
ZHAO Juan ¹ ,
ZHAO Yan ³ ,
WANG Jian-Ping ^1,

1.
1 Beijing National Laboratory for Molecular Sciences, Molecular Reaction Dynamics Laboratory, Institute of Chemistry, Chinese Academy of Sciences, Beijing 100190, P. R. China;
2 University of Chinese Academy of Sciences, Beijing 100049, P. R. China;
3 College of Physics & Electronics Engineering, Shanxi University, Taiyuan 030006, P. R. China

Received Date: 14 January 2015
Available Online: 21 April 2015
Fund Project: 国家自然科学基金(21103200, 20727001, 91121020) (21103200, 20727001, 91121020)中国科学院重大科研装备研制项目(Y2201220)资助 (Y2201220)

In this work, we examined the structural and ―OH stretching vibrational dynamics of ethylene glycol (EG) solvated in acetonitrile (MeCN), acetone (AC), tetrahydrofuran (THF), and dimethylsulfoxide (DMSO) using steady-state linear infrared (IR) spectroscopy and ultrafast pump-probe IR spectroscopy. The results suggested that the frequency position, bandwidth, and vibrational relaxation of the ―OH stretching vibration that participate in the formation of intermolecular hydrogen bonds (IHBs) were strongly influenced by the type of solvent. At least two types of IHBs were detected in the EG solution including clustered solute-solute IHBs and solute-solvent IHBs. Quantum chemical calculations predicted a similar solvent dependence of the ―OH stretching vibrational frequency to that observed in the IR experiments. Furthermore, we found that the IHB-involved ―OH stretching mode in the case of solute-solvent clusters displayed the slowest population relaxation dynamics in the case of EG in MeCN. The relaxation became slightly faster in AC and even faster in THF. The fastest dynamics was observed in the case of EG in DMSO. However, in each solvent environment examined, the IHB-involved ―OH stretching mode in the solute-solute cluster displayed the fastest population relaxation. The results obtained in this study provide further insights into different IHB structural dynamics in co-existing solute-solute and solutesolvent clusters.
- Ethylene glycol,
- Ultrafast pump-probe infrared spectroscopy,
- Solute-solvent cluster,
- Intermolecular hydrogen bond,
- Vibrational relaxation
1. [1]
  
  (1) Nelson, H. C. M.; Finch, J. T.; Luisi, B. F.; Klug, A. Nature 1987, 330 (6145), 221. doi: 10.1038/330221a0
2. [2]
  (2) Sundaralingam, M.; Sekharudu, Y. C. Science 1989, 244 (4910), 1333. doi: 10.1126/science.2734612
3. [3]
  (3) Foti, M. C.; Barclay, L. R. C.; In ld, K. U. J. Am. Chem. Soc. 2002, 124 (43), 12881. doi: 10.1021/ja020757l
4. [4]
  (4) Kim, S. G.; Kim, K. H.; Kim, Y. K.; Shin, S. K.; Ahn, K. H. J. Am. Chem. Soc. 2003, 125 (45), 13819. doi: 10.1021/ja037031p
5. [5]
  (5) Clarkson, J. R.; Baquero, E.; Shubert, V. A.; Myshakin, E. M.; Jordan, K. D.; Zwier, T. S. Science 2005, 307 (5714), 1443. doi: 10.1126/science.1106977
6. [6]
  (6) Markle, T. F.; Mayer, J. M. Angew. Chem. 2008, 120 (4), 750.
7. [7]
  (7) Stillinger, F. H. Science 1980, 209 (4455), 451. doi: 10.1126/science.209.4455.451
8. [8]
  (8) Deàk, J. C.; Rhea, S. T.; Iwaki, L. K.; Dlott, D. D. J. Phys. Chem. A 2000, 104 (21), 4866. doi: 10.1021/jp994492h
9. [9]
  (9) Woutersen, S.; Emmerichs, U.; Bakker, H. J. Science 1997, 278 (5338), 658. doi: 10.1126/science.278.5338.658
10. [10]
  (10) Kropman, M. F.; Nienhuys, H. K.; Woutersen, S.; Bakker, H. J. J. Phys. Chem. A 2001, 105 (19), 4622. doi: 10.1021/jp010057n
11. [11]
  (11) Kropman, M. F.; Bakker, H. J. Science 2001, 291 (5511), 2118. doi: 10.1126/science.1058190
12. [12]
  (12) Woutersen, S.; Bakker, H. J. Nature 1999, 402 (6761), 507. doi: 10.1038/990058
13. [13]
  (13) Bakker, H. J.; Woutersen, S.; Nienhuys, H. K. Chem. Phys. 2000, 258 (2-3), 233.
14. [14]
  (14) Piletic, I. R.; Moilanen, D. E.; Levinger, N. E.; Fayer, M. D. J. Am. Chem. Soc. 2006, 128 (32), 10366. doi: 10.1021/ja062549p
15. [15]
  (15) Fecko, C. J.; Loparo, J. J.; Roberts, S. T.; Tokmakoff, A. J. Chem. Phys. 2005, 122 (5), 054506. doi: 10.1063/1.1839179
16. [16]
  (16) Bakker, H. J.; Gilijamse, J. J.; Lock, A. J. ChemPhysChem 2005, 6 (6), 1146.
17. [17]
  (17) Roberts, S. T.; Ramasesha, K.; Tokmakoff, A. Accounts Chem. Res. 2009, 42 (9), 1239. doi: 10.1021/ar900088g
18. [18]
  (18) Li, Q.; Wu, G.; Yu, Z. J. Am. Chem. Soc. 2006, 128 (5), 1438. doi: 10.1021/ja0569149
19. [19]
  (19) Li, Q.; Wang, N.; Yu, Z. Journal of Molecular Structure- Theorem 2008, 862 (1-3), 74.
20. [20]
  (20) Li, D.; Yang, F.; Han, C.; Zhao, J.; Wang, J. J. Phys. Chem. Lett. 2012, 3 (23), 3665. doi: 10.1021/jz301652v
21. [21]
  (21) Woutersen, S.; Emmerichs, U.; Bakker, H. J. J. Chem. Phys. 1997, 107 (5), 1483. doi: 10.1063/1.474501
22. [22]
  (22) Asbury, J. B.; Steinel, T.; Stromberg, C.; Gaffney, K. J.; Piletic, I. R.; Fayer, M. D. J. Chem. Phys. 2003, 119 (24), 12981.
23. [23]
  (23) Laenen, R.; Simeonidis, K. Chem. Phys. Lett. 1999, 299 (6), 589. doi: 10.1016/S0009-2614(98)01303-7
24. [24]
  (24) Nagy, P. I.; Dunn, W. J.; Ala na, G.; Ghio, C. J. Am. Chem. Soc. 1992, 114 (12), 4752. doi: 10.1021/ja00038a044
25. [25]
  (25) Trindle, C.; Crum, P.; Douglass, K. J. Phys. Chem. A 2003, 107 (32), 6236. doi: 10.1021/jp034598j
26. [26]
  (26) Foti, M. C.; DiLabio, G. A.; In ld, K. U. J. Am. Chem. Soc. 2003, 125 (47), 14642. doi: 10.1021/ja036168c
27. [27]
  (27) Lopes Jesus, A. J.; Rosado, M. T. S.; Leitão, M. L. P.; Redinha, J. S. J. Phys. Chem. A 2003, 107 (19), 3891. doi: 10.1021/jp027123l
28. [28]
  (28) Crittenden, D. L.; Thompson, K. C.; Jordan, M. J. T. J. Phys. Chem. A 2005, 109 (12), 2971. doi: 10.1021/jp045233h
29. [29]
  (29) Han, C.; Zhao, J.; Yang, F.; Wang, J. J. Phys. Chem. A 2013, 117 (29), 6105. doi: 10.1021/jp400096a
30. [30]
  (30) Crupi, V.; Maisano, G.; Majolino, D.; Migliardo, P.; Venuti, V. J. Phys. Chem. A 2000, 104 (17), 3933. doi: 10.1021/jp993900e
31. [31]
  (31) Ma, X.; Wang, J. J. Phys. Chem. A 2009, 113 (21), 6070. doi: 10.1021/jp9016085
32. [32]
  (32) Olschewski, M.; Lindner, J.; Vöhringer, P. Angew. Chem. Int. Edit. 2013, 52 (9), 2602. doi: 10.1002/anie.v52.9
33. [33]
  (33) Liu, Y. L.; Yang, F.; Wang, J. P. Acta Chim. Sin. 2013, 71(5), 761. [刘英亮, 杨帆, 王建平. 化学学报, 2013, 71 (5), 761.] doi: 10.6023/A13020166
34. [34]
  (34) Yang, F.; Liu, Y. L.; Wang, J. P. Acta Phys. -Chim. Sin. 2012, 28 (4), 759. [杨帆, 刘英亮, 王建平. 物理化学学报, 2012, 28 (4), 759.] doi: 10.3866/PKU.WHXB201202023
35. [35]
  (35) Reed, A. E.; Weinhold, F. J. Chem. Phys. 1983, 78 (6), 4066. doi: 10.1063/1.445134
36. [36]
  (36) Reed, A. E.; Weinstock, R. B.; Weinhold, F. J. Chem. Phys. 1985, 83 (2), 735. doi: 10.1063/1.449486
37. [37]
  (37) Frisch, M. J.; Trucks, G.W.; Schlegel, H. B.; et al. Gaussian 09, Revision A. 02; Gaussian Inc.: Pittsburgh, PA, 2009.
1. [1]
  Xinhao Yan , Guoliang Hu , Ruixi Chen , Hongyu Liu , Qizhi Yao , Jiao Li , Lingling Li . Polyethylene Glycol-Ammonium Sulfate-Nitroso R Salt System for the Separation of Cobalt (II). University Chemistry, 2024, 39(6): 287-294. doi: 10.3866/PKU.DXHX202310073
2. [2]
  Qi Wang , Yicong Gao , Feng Lu , Quli Fan . Preparation and Performance Characterization of the Second Near-Infrared Phototheranostic Probe: A New Design and Teaching Practice of Polymer Chemistry Comprehensive Experiment. University Chemistry, 2024, 39(11): 342-349. doi: 10.12461/PKU.DXHX202404141
3. [3]
  Huan LI , Shengyan WANG , Long Zhang , Yue CAO , Xiaohan YANG , Ziliang WANG , Wenjuan ZHU , Wenlei ZHU , Yang ZHOU . Growth mechanisms and application potentials of magic-size clusters of groups Ⅱ-Ⅵ semiconductors. Chinese Journal of Inorganic Chemistry, 2024, 40(8): 1425-1441. doi: 10.11862/CJIC.20240088
4. [4]
  Zhuoming Liang , Ming Chen , Zhiwen Zheng , Kai Chen . Multidimensional Studies on Ketone-Enol Tautomerism of 1,3-Diketones By ¹H NMR. University Chemistry, 2024, 39(7): 361-367. doi: 10.3866/PKU.DXHX202311029
5. [5]
  Jin Tong , Shuyan Yu . Crystal Engineering for Supramolecular Chirality. University Chemistry, 2024, 39(3): 86-93. doi: 10.3866/PKU.DXHX202308113
6. [6]
  Jia Yao , Xiaogang Peng . Theory of Macroscopic Molecular Systems: Theoretical Framework of the Physical Chemistry Course in the Chemistry “101 Plan”. University Chemistry, 2024, 39(10): 27-37. doi: 10.12461/PKU.DXHX202408117
7. [7]
  Rui Li , Jiayu Zhang , Anyang Li . Two Levels of Understanding of Chemical Bonds: a Case of the Bonding Model of Hypervalent Molecules. University Chemistry, 2024, 39(2): 392-398. doi: 10.3866/PKU.DXHX202308051
8. [8]
  Yiling Wu , Peiyao Jin , Shenyue Tian , Ji Zhang . The Star of Sugar Substitutes: An Interview of Erythritol. University Chemistry, 2024, 39(9): 22-27. doi: 10.12461/PKU.DXHX202404034
9. [9]
  Tianlong Zhang , Rongling Zhang , Hongsheng Tang , Yan Li , Hua Li . Online Monitoring and Mechanistic Analysis of 3,5-diamino-1,2,4-triazole (DAT) Synthesis via Raman Spectroscopy: A Recommendation for a Comprehensive Instrumental Analysis Experiment. University Chemistry, 2024, 39(6): 303-311. doi: 10.3866/PKU.DXHX202312006
10. [10]
  Zongfei YANG , Xiaosen ZHAO , Jing LI , Wenchang ZHUANG . Research advances in heteropolyoxoniobates. Chinese Journal of Inorganic Chemistry, 2024, 40(3): 465-480. doi: 10.11862/CJIC.20230306
11. [11]
  Wei Zhong , Dan Zheng , Yuanxin Ou , Aiyun Meng , Yaorong Su . K原子掺杂高度面间结晶的g-C₃N₄光催化剂及其高效H₂O₂光合成. Acta Physico-Chimica Sinica, 2024, 40(11): 2406005-. doi: 10.3866/PKU.WHXB202406005
12. [12]
  Zhanggui DUAN , Yi PEI , Shanshan ZHENG , Zhaoyang WANG , Yongguang WANG , Junjie WANG , Yang HU , Chunxin LÜ , Wei ZHONG . Preparation of UiO-66-NH₂ supported copper catalyst and its catalytic activity on alcohol oxidation. Chinese Journal of Inorganic Chemistry, 2024, 40(3): 496-506. doi: 10.11862/CJIC.20230317
13. [13]
  Xinyu Zhu , Meili Pang . Application of Functional Group Addition Strategy in Organic Synthesis. University Chemistry, 2024, 39(3): 218-230. doi: 10.3866/PKU.DXHX202308106
14. [14]
  Qiuyang LUO , Xiaoning TANG , Shu XIA , Junnan LIU , Xingfu YANG , Jie LEI . Application of a densely hydrophobic copper metal layer in-situ prepared with organic solvents for protecting zinc anodes. Chinese Journal of Inorganic Chemistry, 2024, 40(7): 1243-1253. doi: 10.11862/CJIC.20240110
15. [15]
  Ronghao Zhao , Yifan Liang , Mengyao Shi , Rongxiu Zhu , Dongju Zhang . Investigation into the Mechanism and Migratory Aptitude of Typical Pinacol Rearrangement Reactions: A Research-Oriented Computational Chemistry Experiment. University Chemistry, 2024, 39(4): 305-313. doi: 10.3866/PKU.DXHX202309101
16. [16]
  Xiaxue Chen , Yuxuan Yang , Ruolin Yang , Yizhu Wang , Hongyun Liu . Adjustable Polychromatic Fluorescence: Investigating the Photoluminescent Properties of Copper Nanoclusters. University Chemistry, 2024, 39(9): 328-337. doi: 10.3866/PKU.DXHX202308019
17. [17]
  Yong Shu , Xing Chen , Sai Duan , Rongzhen Liao . How to Determine the Equilibrium Bond Distance of Homonuclear Diatomic Molecules: A Case Study of H₂. University Chemistry, 2024, 39(7): 386-393. doi: 10.3866/PKU.DXHX202310102
18. [18]
  Peng ZHOU , Xiao CAI , Qingxiang MA , Xu LIU . Effects of Cu doping on the structure and optical properties of Au₁₁(dppf)₄Cl₂ nanocluster. Chinese Journal of Inorganic Chemistry, 2024, 40(7): 1254-1260. doi: 10.11862/CJIC.20240047
19. [19]
  Laiying Zhang , Yinghuan Wu , Yazi Yu , Yecheng Xu , Haojie Zhang , Weitai Wu . Innovation and Practice of Polymer Chemistry Experiment Teaching for Non-Polymer Major Students of Chemistry: Taking the Synthesis, Solution Property, Optical Performance and Application of Thermo-Sensitive Polymers as an Example. University Chemistry, 2024, 39(4): 213-220. doi: 10.3866/PKU.DXHX202310126
20. [20]
  Danqing Wu , Jiajun Liu , Tianyu Li , Dazhen Xu , Zhiwei Miao . Research Progress on the Simultaneous Construction of C—O and C—X Bonds via 1,2-Difunctionalization of Olefins through Radical Pathways. University Chemistry, 2024, 39(11): 146-157. doi: 10.12461/PKU.DXHX202403087

Get Citation

PDF

XML

Metrics

PDF Downloads(278)
Abstract views(428)
HTML views(11)

通讯作者: 陈斌, bchen63@163.com

1.
沈阳化工大学材料科学与工程学院沈阳 110142