CHINESE JOURNAL OF ENERGETIC MATERIALS
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变温红外光谱法研究FOX-7的相变(英)
作者:
作者单位:

(1. 中国工程物理研究院化工材料研究所, 四川 绵阳 621999; 2. 西南科技大学材料科学与工程学院, 四川 绵阳 621010)

作者简介:

ZHANG Hong-li(1989-), female, graduated student, major in the preparation and characterization of the microstructures of energetic materials. e-mail: zhanghl0817@163.com Corresponding Author: LIU Yu(1976-), male, associate professor, major in the preparation and characterization of the microstructures of energetic materials. e-mail: liuyu307@caep.cn

通讯作者:

LIU Yu(1976-), male, associate professor, major in the preparation and characterization of the microstructures of energetic materials. e-mail: liuyu307@caep.cn

基金项目:

National Science Foundations of China(11372290,11572295) Biography: ZHANG Hong-li(1989-), female, graduated student, major in the preparation and characterization of the microstructures of energetic materials. e-mail: zhanghl0817@163.com


Investigation of the Phase Transitions of FOX-7 by Temperature-dependent FTIR Spectroscopy
Author:
Affiliation:

(1. Institute of Chemical Materials, China Academy of Engineering Physics (CAEP), Mianyang 621999, China; 2. Southwest University of Science and Technology, Mianyang 621010, China)

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    摘要:

    采用变温红外光谱法对高能钝感炸药1, 1-二氨基-2, 2-二硝基乙烯(FOX-7)αββγ两种晶型转变进行了研究,讨论了FOX-7相变过程中的分子间氢键作用和分子结构。55~122 ℃,ν11[NH2 (νas)]和ν10 [NO2 (νs)]频率移动为20 cm-1左右,ν18[C—NO2(ν)]消失;122~190 ℃,ν12 [C—NH2(ν)]消失,ν20[NO2(ω)]转变为新的宽峰。红外光谱结果表明:在FOX-7相变过程中,分子间氢键作用发生改变,分子结构改变。此外,随着温度的升高,在αβ的相转变中,氢键长度变化不符合线性热膨胀公式,并且ν11ν4[NH2 (νas)与2ν5 NH2 (γ)的费米共振]、ν7[NO2(νas)]和ν10等谱带表现出与α-和β-FOX-7均不同的特征频率,表明FOX-7在αβ相变过程中要经历一种过渡态。

    Abstract:

    Two kinds of phase transitions (αβ and βγ) of the insensitive high explosive, 1, 1-diamino-2, 2-dinitroethylene(FOX-7), have been investigated by temperature-dependent Fourier transform infrared(FTIR) spectroscopy, and the effects of intermolecular H-bonding interactions and molecular structure in the phase transitions of FOX-7 were discussed. The frequency of ν11 [NH2 (νas)] and ν10 [NO2 (νs)] shifts about 20 cm-1, together with the loss of ν18 [C—NO2 (ν)] in the range of 55 ℃ to 122 ℃, while ν12 [C—NH2(ν)] disappears and ν20[NO2(ω)] transforms to another broad peaks in the range of 122 ℃ to 190 ℃. The analytical results of the IR spectra indicate that intermolecular hydrogen bonding interactions change in the phase transitions of the FOX-7, which cause the changes of the molecular structure. Moreover, in the process of αβ transition, the changes of H-bonding length with increasing temperature are not consistent with the linear thermal expansion formula, and ν11ν4[Fermi resonance between the NH2 (νas) and the overtone mode of the NH2 scissor (2ν5)]、ν7 and ν10[NO2(νas)] show special frequencies, which are different from those of α and β-FOX-7. The results confirm the transition state in the αβ transition.

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张红梨,刘渝,张浩斌,等.变温红外光谱法研究FOX-7的相变(英)[J].含能材料, 2016, 24(9):880-885. DOI:10.11943/j. issn.1006-9941.2016.09.011.
ZHANG Hong-li, LIU Yu, ZHANG Hao-bin, et al. Investigation of the Phase Transitions of FOX-7 by Temperature-dependent FTIR Spectroscopy[J]. Chinese Journal of Energetic Materials, 2016, 24(9):880-885. DOI:10.11943/j. issn.1006-9941.2016.09.011.

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历史
  • 收稿日期: 2016-02-26
  • 最后修改日期: 2016-05-20
  • 录用日期: 2016-05-31
  • 在线发布日期: 2016-09-19
  • 出版日期: 2016-10-10