• Spectroscopy and Spectral Analysis
  • Vol. 41, Issue 1, 177 (2021)
Xiao-jing WU1、1、*, Zhi LI1、1, Zi-xuan LI1、1, Xing-xing LI1、1, and Long-jiu CHENG1、1
Author Affiliations
  • 1[in Chinese]
  • 11. School of Chemistry and Chemical Engineering, Hefei University of Technology, Hefei 230009, China
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    DOI: 10.3964/j.issn.1000-0593(2021)01-0177-06 Cite this Article
    Xiao-jing WU, Zhi LI, Zi-xuan LI, Xing-xing LI, Long-jiu CHENG. Two-Dimensional Correlation Raman Spectroscopic Analysis of CuCl2/DMF Solution Under Temperature Disturbance[J]. Spectroscopy and Spectral Analysis, 2021, 41(1): 177 Copy Citation Text show less
    Raman spectra of C—N in pure DMF (a) and 0.84 mol·L-1 CuCl2/DMF (b) at different temperatures
    Fig. 1. Raman spectra of C—N in pure DMF (a) and 0.84 mol·L-1 CuCl2/DMF (b) at different temperatures
    MW2D Raman spectra of C—N in pure DMF (a) and0.84 mol·L-1 CuCl2/DMF (b) at temperature range 25~81 ℃
    Fig. 2. MW2D Raman spectra of C—N in pure DMF (a) and0.84 mol·L-1 CuCl2/DMF (b) at temperature range 25~81 ℃
    2D Raman spectra of C—N in pure DMF and 0.84 mol·L-1 CuCl2/DMF under temperature disturbance(a): Synchronous 2D Raman in pure DMF; (b): Asynchronous 2D Raman in pure DMF;(c): Synchronous 2D Raman in CuCl2/DMF; (d): Asynchronous 2D Raman in CuCl2/DMF
    Fig. 3. 2D Raman spectra of C—N in pure DMF and 0.84 mol·L-1 CuCl2/DMF under temperature disturbance
    (a): Synchronous 2D Raman in pure DMF; (b): Asynchronous 2D Raman in pure DMF;(c): Synchronous 2D Raman in CuCl2/DMF; (d): Asynchronous 2D Raman in CuCl2/DMF
    B3LYP optimized the possible structures of (DMF)2 and [Cu(DMF)n]2+(n=1~6)
    Fig. 4. B3LYP optimized the possible structures of (DMF)2 and [Cu(DMF)n]2+(n=1~6)
    System
    (n)
    ΔE/
    (kJ·mol-1)
    ΔH/
    (kJ·mol-1)
    ΔG/
    (kJ·mol-1)
    1-974.8-977.3-948.9
    2-373.1-375.6-330.6
    3-227.1-229.5-188.0
    4-177.3-179.7-126.3
    5-88.2-90.6-47.0
    6-59.9-62.4-10.7
    Table 1. Thermodynamic parameters of [Cu(DMF)n]2+(n=1~6)
    Xiao-jing WU, Zhi LI, Zi-xuan LI, Xing-xing LI, Long-jiu CHENG. Two-Dimensional Correlation Raman Spectroscopic Analysis of CuCl2/DMF Solution Under Temperature Disturbance[J]. Spectroscopy and Spectral Analysis, 2021, 41(1): 177
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