Rotational spectroscopy of 1,2-dihydronaphthalene, 1,4-dihydronaphthalene, and 1,2,3,4-tetrahydronaphthalene

被引:0
作者
Li, Yuting [1 ]
Shen, Fang [1 ]
Feng, Yan [1 ]
Lv, Wenqi [1 ]
Huang, Haiying [1 ]
Huang, Jinxi [1 ]
Feng, Gang [1 ]
机构
[1] Chongqing Univ, Sch Chem & Chem Engn, Chongqing 401331, Peoples R China
基金
中国国家自然科学基金;
关键词
POLYCYCLIC AROMATIC-HYDROCARBONS; INFRARED-EMISSION BANDS; MICROWAVE-SPECTRUM; INTERSTELLAR; DISCOVERY; AZULENE; PAHS;
D O I
10.1063/5.0257949
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 rotational spectra of 1,2-dihydronaphthalene (1,2-DHN), 1,4-dihydronaphthalene (1,4-DHN), and 1,2,3,4-tetrahydronaphthalene (1,2,3,4-THN) were measured and analyzed. A single conformation was detected for each molecule. The measurements for the parent isotopologues were extended to include the rotational spectra of all mono-substituted 13C isotopologues for 1,2-DHN and 1,4-DHN. Through the analysis of the experimental spectra, the rotational constants and quartic centrifugal distortion constants were accurately determined. The skeletal structures of 1,2-DHN and 1,4-DHN were derived based on the measured rotational constants. The precise spectroscopic parameters of the three molecules provided in this study enable future exploration of the chemistry of these species in the laboratory and interstellar medium.
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页数:7
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共 43 条
  • [1] Agndez M., 2023, Astron. Astrophys, V677, pL3, DOI [10.1051/0004-6361/202346373, DOI 10.1051/0004-6361/202346373]
  • [2] INTERSTELLAR POLYCYCLIC AROMATIC-HYDROCARBONS - THE INFRARED-EMISSION BANDS, THE EXCITATION EMISSION MECHANISM, AND THE ASTROPHYSICAL IMPLICATIONS
    ALLAMANDOLA, LJ
    TIELENS, AGGM
    BARKER, JR
    [J]. ASTROPHYSICAL JOURNAL SUPPLEMENT SERIES, 1989, 71 (04) : 733 - 775
  • [3] POLYCYCLIC AROMATIC-HYDROCARBONS AND THE UNIDENTIFIED INFRARED-EMISSION BANDS - AUTO EXHAUST ALONG THE MILKY-WAY
    ALLAMANDOLA, LJ
    TIELENS, AGGM
    BARKER, JR
    [J]. ASTROPHYSICAL JOURNAL, 1985, 290 (01) : L25 - L28
  • [4] Gabedit-A Graphical User Interface for Computational Chemistry Softwares
    Allouche, Abdul-Rahman
    [J]. JOURNAL OF COMPUTATIONAL CHEMISTRY, 2011, 32 (01) : 174 - 182
  • [5] FABRY-PEROT CAVITY PULSED FOURIER-TRANSFORM MICROWAVE SPECTROMETER WITH A PULSED NOZZLE PARTICLE SOURCE
    BALLE, TJ
    FLYGARE, WH
    [J]. REVIEW OF SCIENTIFIC INSTRUMENTS, 1981, 52 (01) : 33 - 45
  • [6] DENSITY-FUNCTIONAL THERMOCHEMISTRY .3. THE ROLE OF EXACT EXCHANGE
    BECKE, AD
    [J]. JOURNAL OF CHEMICAL PHYSICS, 1993, 98 (07) : 5648 - 5652
  • [7] Discovery of the Pure Polycyclic Aromatic Hydrocarbon Indene (c-C9H8) with GOTHAM Observations of TMC-1
    Burkhardt, Andrew M.
    Long Kelvin Lee, Kin
    Bryan Changala, P.
    Shingledecker, Christopher N.
    Cooke, Ilsa R.
    Loomis, Ryan A.
    Wei, Hongji
    Charnley, Steven B.
    Herbst, Eric
    McCarthy, Michael C.
    McGuire, Brett A.
    [J]. ASTROPHYSICAL JOURNAL LETTERS, 2021, 913 (02)
  • [8] Rotational spectra of five cyano derivatives of fluorene
    Cabezas, Carlos
    Janeiro, Jesus
    Steber, Amanda L.
    Perez, Dolores
    Bermudez, Celina
    Guitian, Enrique
    Lesarri, Alberto
    Cernicharo, Jose
    [J]. PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2024, 26 (36) : 23703 - 23709
  • [9] Cyano-Polycyclic Aromatic Hydrocarbon Interstellar Candidates: Laboratory Identification, Equilibrium Structure and Astronomical Search of Cyanobiphenylene
    Cabezas, Carlos
    Janeiro, Jesus
    Perez, Dolores
    Li, Wenqin
    Agundez, Marcelino
    Steber, Amanda L.
    Guitian, Enrique
    Demaison, Jean
    Perez, Cristobal
    Cernicharo, Jose
    Lesarri, Alberto
    [J]. JOURNAL OF PHYSICAL CHEMISTRY LETTERS, 2024, 15 (29): : 7411 - 7418
  • [10] LOW-ENERGY VIBRATIONS OF INDENE
    CAMINATI, W
    [J]. JOURNAL OF THE CHEMICAL SOCIETY-FARADAY TRANSACTIONS, 1993, 89 (23): : 4153 - 4155