Excited-state dynamics of highly strained 1,2,3-tri-tert-butylanthraquinone undergoing valence isomerization

被引:5
|
作者
Nakayama, T [1 ]
Amijima, Y [1 ]
Ushida, K [1 ]
Hamanoue, K [1 ]
机构
[1] KYOTO INST TECHNOL,DEPT CHEM,SAKYO KU,KYOTO 606,JAPAN
关键词
D O I
10.1016/0009-2614(96)00690-2
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
Sub-picosecond laser photolysis of the title compound (TBAQ) reveals that a broad absorption band (at 450-750 nm) due to the lowest excited singlet state ((1)TBAQ') decreases with a very short lifetime of 1.7 ps and then an absorption band due to the lowest excited tripler state ((3)TBAQ*) remains as the residual absorption. The fast decay channel of (1)TBAQ* is probably ascribed to the valence isomerization to yield a hemi-Dewar type isomer reported by Miki et al., considering the distorted molecular structure of TBAQ estimated by molecular mechanics calculations.
引用
收藏
页码:663 / 668
页数:6
相关论文
共 42 条
  • [21] Excited-state structural dynamics and vibronic coupling of 1,3-dithiole-2-thione - resonance Raman spectroscopy and density functional theory calculation study
    Wang, Huigang
    Liu, Bo
    Wan, Junmin
    Xu, Jun
    Zheng, Xuming
    JOURNAL OF RAMAN SPECTROSCOPY, 2009, 40 (08) : 992 - 997
  • [22] Resonance Raman intensity analysis of the excited-state photochemical dynamics of dimethyl 1,3-dithiole-2-thione-4,5-dicarboxylate in the A-band absorption
    Liu, Bo
    Wu, Bin
    Xu, Jun
    Wu, Zhangzhu
    Zhao, Yanying
    Zheng, Xuming
    Wang, Huigang
    JOURNAL OF RAMAN SPECTROSCOPY, 2010, 41 (10) : 1185 - 1193
  • [23] Excited-State Deactivation Mechanism of 3,5-bis(2-hydroxyphenyl)-1H-1,2,4-triazole: Electronic Structure Calculations and Nonadiabatic Dynamics Simulations
    Wu, Jiahui
    Chen, Xiaohang
    Peng, Ling-Ya
    Cui, Ganglong
    Xia, Shu-Hua
    JOURNAL OF PHYSICAL CHEMISTRY A, 2022, 126 (25): : 4002 - 4012
  • [24] Excited-state dynamics of all-trans-1,3,5,7-octatetraene in solution.: Direct observation of internal conversion from the S2 to S1 state and relaxation processes in the S1 state
    Ohta, K
    Naitoh, Y
    Tominaga, K
    Yoshihara, K
    JOURNAL OF PHYSICAL CHEMISTRY A, 2001, 105 (16): : 3973 - 3980
  • [25] Highly Selective "Turn-On" Fluorescent and Colorimetric Sensing of Fluoride Ion Using 2-(2-Hydroxyphenyl)-2,3-dihydroquinolin-1H)-one based on Excited-State Proton Transfer
    Kanagaraj, Kuppusamy
    Pitchumani, Kasi
    CHEMISTRY-AN ASIAN JOURNAL, 2014, 9 (01) : 146 - 152
  • [26] Energies and excited-state dynamics of 1Bu+, 1Bu- and 3Ag- states of carotenoids bound to LH2 antenna complexes from purple photosynthetic bacteria
    Christiana, Rebecca
    Miki, Takeshi
    Kakitani, Yoshinori
    Aoyagi, Shiho
    Koyama, Yasushi
    Limantara, Leenawaty
    CHEMICAL PHYSICS LETTERS, 2009, 480 (4-6) : 289 - 295
  • [27] Effects of the second hydration shell on excited-state multiple proton transfer: dynamics simulations of 7-azaindole:(H2O)1–5 clusters in the gas phase
    Nawee Kungwan
    Khanittha Kerdpol
    Rathawat Daengngern
    Supa Hannongbua
    Mario Barbatti
    Theoretical Chemistry Accounts, 2014, 133
  • [28] Inorganic Cage Motion Dominates Excited-State Dynamics in 2D-Layered Perovskites (CxH2x+1NH3)2 PbI4 (x=4-9)
    Mauck, Catherine M.
    France-Lanord, Arthur
    Oendra, Alexander C. Hernandez
    Dahod, Nabeel S.
    Grossman, Jeffrey C.
    Tisdale, William A.
    JOURNAL OF PHYSICAL CHEMISTRY C, 2019, 123 (45): : 27904 - 27916
  • [29] Relaxation dynamics of highly vibrationally excited picoline isomers (Evib=38 300 cm-1) with CO2:: The role of state density in impulsive collisions
    Miller, EM
    Murat, L
    Bennette, N
    Hayes, M
    Mullin, AS
    JOURNAL OF PHYSICAL CHEMISTRY A, 2006, 110 (09): : 3266 - 3272
  • [30] Effects of the second hydration shell on excited-state multiple proton transfer: dynamics simulations of 7-azaindole:(H2O)1-5 clusters in the gas phase
    Kungwan, Nawee
    Kerdpol, Khanittha
    Daengngern, Rathawat
    Hannongbua, Supa
    Barbatti, Mario
    THEORETICAL CHEMISTRY ACCOUNTS, 2014, 133 (05) : 1 - 11