Rotational Spectrum of Eugenol As Analyzed with Double Resonance and Grid-Based Autofit

Riffe Erika J.; Shipman Steven T.; Gaster Sydney A.; Funderburk Cameron M.; Brown Gordon G.

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Rotational Spectrum of Eugenol As Analyzed with Double Resonance and Grid-Based Autofit

机译：用双共振和基于网格的自动专用分析丁香酚的旋转光谱

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The molecule eugenol was extracted from cloves via steam-distillation, and its rotational spectrum from 3-18 GHz was acquired with a chirped-pulsed Fourier transform microwave spectrometer. This spectrum was analyzed via two separate methods in parallel, one employing several microwave-microwave double resonance measurements and the other using a newly written version of the Autofit program. Both methods yielded rotational constants in excellent agreement with predictions from ab initio calculations. The relative merits of the different analysis methods are discussed.

机译：通过蒸汽蒸馏从纤维蒸发中萃取分子丁香酚，并通过啁啾脉冲傅里叶变换微波谱仪获得其旋转光谱从3-18GHz。通过两个单独的方法并行地分析该频谱，一个采用几种微波微波双谐振测量和另一个使用新写的自动专业计划的方法。两种方法都会产生旋转常数，与AB Initio计算的预测出来的旋转常数。讨论了不同分析方法的相对优点。

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《The journal of physical chemistry, A. Molecules, spectroscopy, kinetics, environment, & general theory》 |2019年第5期|共9页
作者
Riffe Erika J.; Shipman Steven T.; Gaster Sydney A.; Funderburk Cameron M.; Brown Gordon G.;
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作者单位

New Coll Florida Div Nat Sci Sarasota FL 34243 USA;

New Coll Florida Div Nat Sci Sarasota FL 34243 USA;

Coker Coll Dept Sci &

Math Hartsville SC 29550 USA;

Coker Coll Dept Sci &

Math Hartsville SC 29550 USA;

Coker Coll Dept Sci &

Math Hartsville SC 29550 USA;

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正文语种 eng
中图分类物理化学（理论化学）、化学物理学;
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1. Rotational Spectrum of Eugenol As Analyzed with Double Resonance and Grid-Based Autofit [J] . Riffe Erika J., Shipman Steven T., Gaster Sydney A., The journal of physical chemistry, A. Molecules, spectroscopy, kinetics, environment, & general theory . 2019,第5期

机译：用双共振和基于网格的自动专用分析丁香酚的旋转光谱
2. Pure rotational spectrum of CaCH_3(X-tilde~2A_1) using the pump/probe microwave-optical double resonance (PPMODR) technique [J] . Kei-ichi C. Namiki, Timothy C. Steimle The Journal of Chemical Physics . 1999,第23期

机译：CaCH_3（X-tilde〜2A_1）的纯旋转光谱，采用泵浦/探针微波双共振技术（PPMODR）
3. Rotational Resolution in the VUV-Spectrum of CF_3I via Infrared-Ultraviolet Double Resonance Experiments [J] . Albert H. Bahnmaier, Harold Jones Zeitschrift fur Naturforschung. A, A journal of physical sciences . 1995,第9期

机译：CF_3I的VUV光谱中通过红外-紫外线双共振实验的旋转分辨率
4. State to state rotational relaxation rate constants for the CO+X series (X=CO, He, and Ne) using IR-IR double resonance experiments. Comparing theory to experiment [C] . David A. Hostutler, Tony C. Smith, Gordon D. Hager, High-Power Laser Ablation V pt.2 . 2004

机译：使用IR-IR双共振实验对CO + X系列（X = CO，He和Ne）进行状态到状态的旋转弛豫速率常数。理论与实验比较
5. Rotational-echo double resonance NMR characterization of DNA packaging in bacteriophage T4 and of Saccharomyces cerevisiae lumazine synthase-inhibitor complexes [D] . Yu, Tsyr-Yan 2008

机译：旋转回波双共振NMR表征噬菌体T4中的DNA包装和酿酒酵母鲁嗪合酶-抑制剂复合物
6. Multiple Locations of Peptides in the HydrocarbonCore of Gel-Phase Membranes Revealed by Peptide 13C toLipid 2H Rotational-Echo Double-Resonance Solid-State NuclearMagnetic Resonance [O] . Li Xie, Lihui Jia, Shuang Liang, -1

机译：碳氢化合物中肽的多个位置肽13C揭示的凝胶相膜核心脂质2H旋转回波双共振固态核磁共振
7. A precise analysis of the 1H nuclear magnetic resonance spectrum of 2-phenyl-1,3-dithiane. Ring pucker, signs of long-range J(H,H), internal rotational barrier, and van der Waals shifts [O] . Ted Schaefer, Jeremy P. Kunkel, Robert W. Schurko, 1994

机译：2-苯基-1,3-二思的1H核磁共振谱的精确分析。环形褶皱，远程J（H，H），内部旋转屏障和范德瓦尔斯班次的迹象
8. The Rotational Spectrum of the X Doublet Sigma Plus State of the Ca35C1 Radical Using Laser Microwave Optical Double Resonance. [R] . Domaille, P. J., Steimle, T. C., Harris, D. O. 1977

机译：利用激光微波光学双共振技术研究X双峰sigma + Ca35C1自由基的旋转光谱。

Rotational Spectrum of Eugenol As Analyzed with Double Resonance and Grid-Based Autofit

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