Dipole moment and solvatochromism of benzoic acid liquid crystals: Tuning the dipole moment and molecular orbital energies by substituted Au under external electric field

被引:11
作者
Sidir, Yadigar Gulseven [1 ]
Sidir, Isa [1 ]
Demiray, Ferhat [2 ]
机构
[1] Bitlis Eren Univ, Fac Arts & Sci, Dept Phys, TR-13000 Bitlis, Turkey
[2] Abant Izzet Baysal Univ, Fac Engn & Architecture, Dept Comp Engn, TR-14280 Bolu, Turkey
关键词
4-Alkyloxybenzoic acid; Dipole moment; Solvatochromism; Tuning band gap; External electric field effect; Substituting Au; EXCITED-STATE; TERMINAL SUBSTITUENTS; MESOPHASE BEHAVIOR; FLUORESCENCE; ABSORPTION; TEMPERATURE; MIXTURES; POLARITY; ACCEPTOR; SPECTRA;
D O I
10.1016/j.molstruc.2017.02.055
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
The optical absorption and steady-state fluorescence spectra of 4-heptyloxybenzoic acid (4hoba), 4-octyloxybenzoic acid (400ba) and 4-nonyloxybenzoic acid (4noba) liquid crystals have been measured in a series of different polarity organic solvents. The ground state (mu(g)) and excited state (mu(e)) dipole moments of the monomeric and dimeric 4-alkyloxybenzoic acid liquid crystals have been obtained by means of different solvatochromic shift methods. HOMO-LUMO gaps (HLG) and dipole moments have been tuned by applying external electric (EF) field on monomer, dimer and Au substituted monomer and dimer liquid crystal structures. By applying external electric field, Au substituted monomer liquid crystals display semiconductor character, while Au substituted dimer liquid crystals gain metallic character under E = 0.04 V/angstrom. Eventuated specific and non-specific interactions between solvent and solute in solvent medium have been expounded by using LSER (Linear Solvation Energy Relationships). (C) 2017 Elsevier B.V. All rights reserved.
引用
收藏
页码:440 / 452
页数:13
相关论文
共 59 条
  • [1] Mesophase behavior of binary and ternary mixtures of benzoic acids bearing terminal substituents of different polarity and chain-lengths
    Ahmed, H. A.
    Naoum, M. M.
    [J]. THERMOCHIMICA ACTA, 2014, 575 : 122 - 128
  • [2] [Anonymous], 1992, Progress in Photochemistry and Photophysics
  • [3] FOURIER-TRANSFORM FAR-INFRARED SPECTROSCOPY OF THE HYDROGEN-BOND IN 4-N-ALKOXYBENZOIC ACIDS
    ANTONOVA, K
    PETROV, M
    KIROV, N
    TENEV, T
    RATAJCZAK, H
    [J]. VIBRATIONAL SPECTROSCOPY, 1995, 8 (02) : 193 - 198
  • [4] BAKHSHIEV NG, 1964, OPT SPEKTROSK+, V16, P821
  • [5] DENSITY-FUNCTIONAL THERMOCHEMISTRY .3. THE ROLE OF EXACT EXCHANGE
    BECKE, AD
    [J]. JOURNAL OF CHEMICAL PHYSICS, 1993, 98 (07) : 5648 - 5652
  • [6] ZUR THEORIE DES EINFLUSSES VON LOSUNGSMITTELN AUF DIE ELEKTROENSPEKTREN DER MOLEKULE
    BILOT, L
    KAWSKI, A
    [J]. ZEITSCHRIFT FUR NATURFORSCHUNG PART A-ASTROPHYSIK PHYSIK UND PHYSIKALISCHE CHEMIE, 1962, A 17 (07): : 621 - &
  • [7] Laser-induced fluorescence and dispersed fluorescence studies of the donor-acceptor system 4-amino 3-methyl benzoic acid methyl ester and its solvated clusters: Evidence of excited-state charge-transfer reaction
    Chakraborty, Amrita
    Le Barbu-Debus, Katia
    Zehnacker-Rentien, Anne
    Guchhait, Nikhil
    [J]. JOURNAL OF PHOTOCHEMISTRY AND PHOTOBIOLOGY A-CHEMISTRY, 2010, 213 (2-3) : 164 - 170
  • [8] CHAMMA A, 1970, CR ACAD SCI C CHIM, V270, P1901
  • [9] Inhibitory effects on mushroom tyrosinase by p-alkoxybenzoic acids
    Chen, QX
    Song, KK
    Qiu, L
    Liu, XD
    Huang, H
    Guo, HY
    [J]. FOOD CHEMISTRY, 2005, 91 (02) : 269 - 274
  • [10] THERMOTROPIC LIQUID-CRYSTALLINE COMPOUNDS WITH LATERAL LONG-CHAIN SUBSTITUENTS(IV) - PHYSICAL-PROPERTIES OF 1,4-BIS-[4-NORMAL-OCTYLOXYBENZOYLOXY]-2-NORMAL-ALKYLBENZENES
    DEMUS, D
    DIELE, S
    HAUSER, A
    LATIF, I
    SELBMANN, C
    WEISSFLOG, W
    [J]. CRYSTAL RESEARCH AND TECHNOLOGY, 1985, 20 (11) : 1547 - 1558