NORMAL VIBRATIONAL ANALYSIS OF CIS-POLYACETYLENE

被引:0
|
作者
王建瓴
景遐斌
冯之榴
机构
[1] Academia Sinica
[2] Changchun
[3] Changchun Institute of Applied Chemistry
关键词
Polyacetylene; IR of Polyacetylene; Raman spectra of polyacetylene; Vibrational spectra of polyacetylene; Vibrational analysis of polyacetylene;
D O I
暂无
中图分类号
学科分类号
摘要
The normal vibrational calculation was carried out on cis-polyacetylene(PA) and its model compound, cis, trans-2, 4--hexadiene. Based on the observed IR and Raman frequencies, force constants relevant to the cis-structure were refined. Finally a force field common for cis-PA, trans-PA and three model moleculaes was obtained. The observed spectra of cis-PA were theoretically assigned and the similarities and differences between the cis-and trans- conjugate systems were discussed on the basis of normal coordinate calculation.
引用
收藏
页码:308 / 315
页数:8
相关论文
共 50 条
  • [41] Conformation and oxidation transformations in cis-polyacetylene films irradiated by an electron beam
    Roshchupkina, OS
    Tkachenko, LI
    Efimov, ON
    SYNTHETIC METALS, 1997, 90 (02) : 89 - 92
  • [42] NORMAL VIBRATIONAL ANALYSIS OF TRANS-POLYACETYLENE
    王建瓴
    景遐斌
    冯之榴
    Chinese Journal of Polymer Science, 1987, (04) : 316 - 324
  • [43] MOLECULAR-GEOMETRY OF CIS-POLYACETYLENE AND TRANS-POLYACETYLENE BY NUTATION NMR-SPECTROSCOPY
    YANNONI, CS
    CLARKE, TC
    PHYSICAL REVIEW LETTERS, 1983, 51 (13) : 1191 - 1193
  • [44] MOMENTUM-DEPENDENT DIELECTRIC FUNCTION OF THE CIS-TRANSOID CONFORMATION OF CIS-POLYACETYLENE
    FRITZSCHE, H
    FINK, J
    NUCKER, N
    SCHEERER, B
    LEISING, G
    PHYSICAL REVIEW B, 1989, 40 (11) : 8033 - 8036
  • [45] Li- and B-decorated cis-polyacetylene: A computational study
    Li, S.
    Jena, P.
    PHYSICAL REVIEW B, 2008, 77 (19):
  • [46] PRECISE MEASUREMENT OF HFS CONSTANT OF THE MUONIUM SUBSTITUTED RADICAL IN CIS-POLYACETYLENE
    NISHIYAMA, K
    ISHIDA, K
    NAGAMINE, K
    MATSUZAKI, T
    KUNO, Y
    SHIRAKAWA, H
    KIEFL, R
    BREWER, JH
    HYPERFINE INTERACTIONS, 1986, 32 (1-4): : 551 - 556
  • [47] BIPOLARON INTERPRETATION OF RESONANCE RAMAN-SCATTERING SPECTRA FOR CIS-POLYACETYLENE
    GUO, YJ
    YU, L
    SOLID STATE COMMUNICATIONS, 1986, 58 (06) : 407 - 411
  • [48] Molecular Structures and Vibrational Spectra of trans- and cis-Polyacetylene and Their Oligoenes Revisited Using Density Functional Theory Calculations
    Furuya, Kazuhiko
    Sakamoto, Akira
    Tasumi, Mitsuo
    JOURNAL OF PHYSICAL CHEMISTRY A, 2023, 127 (25): : 5344 - 5359
  • [49] CRYSTAL-STRUCTURE OF PRISTINE AND IODINE-DOPED CIS-POLYACETYLENE
    CHIEN, JCW
    KARASZ, FE
    SHIMAMURA, K
    MACROMOLECULES, 1982, 15 (04) : 1012 - 1017
  • [50] VERY HIGH-FIELD EPR STUDY OF CIS-POLYACETYLENE AND TRANSPOLYACETYLENE
    KRINICHNYI, VI
    PELEKH, AE
    LEBEDEV, YS
    TKACHENKO, LI
    KOZUB, GI
    BARRA, AL
    BRUNEL, LC
    ROBERT, JB
    APPLIED MAGNETIC RESONANCE, 1994, 7 (04) : 459 - 467