Reactions of neutral gas-phase yttrium atoms with two cyclohexadiene isomers.
نویسندگان
چکیده
The reactions of neutral ground-state yttrium (Y) atoms with 1,3- and 1,4-cyclohexadiene (CHD) were studied using crossed molecular beams. Formation of YC(6)H(6) + H(2) and YH(2) + C(6)H(6) was observed for both isomers at collision energies (E(coll)) of 31.3 and 13.0 kcal/mol. Measured product branching ratios at E(coll) = 31.3 kcal/mol indicated that YH(2) + C(6)H(6) was the dominant channel, accounting for >97% of the products. An additional minor product channel, YC(4)H(4) + C(2)H(4), was observed for 1,3-CHD at the higher E(coll). The reaction threshold for YC(4)H(4) formation was determined to be 29.5 ± 2.0 kcal/mol based on fits to the data.
منابع مشابه
Density functional theory study of small vanadium oxide clusters.
Density functional theory is employed to study structure and stability of small neutral vanadium oxide clusters in the gas phase. BPW91/LANL2DZ level of theory is used to obtain structures of VOy (y=1-5), V2Oy (y=2-7), V3Oy (y=4-9), and V4Oy (y=7-12) clusters. Enthalpies of growth and fragmentation reactions of the lowest energy isomers of vanadium oxide molecules are also obtained to study the...
متن کاملOff-line studies of the laser ionization of yttrium at the IGISOL facility
A laser ion source is under development at the IGISOL facility, Jyväskylä, in order to address deficiencies in the ion guide technique. The key elements of interest are those of a refractory nature, whose isotopes and isomers are widely studied using both laser spectroscopic and high precision mass measurement techniques. Yttrium has been the first element of choice for the new laser ion source...
متن کاملGas phase thermal reactions of exo-8-cyclopropyl-bicyclo[4.2.0]oct-2-ene (1-exo).
The title compound 1-exo (with minor amounts of its C8 epimer 1-endo) was prepared by Wolff-Kishner reduction of the cycloadduct of 1,3-cyclohexadiene and cyclopropylketene. The [1,3]-migration product 2-endo was synthesized by efficient selective cyclopropanation of endo-5-vinylbicyclo[2.2.2]oct-2-ene at the exocyclic π-bond. Gas phase thermal reactions of 1-exo afforded C8 epimerization to 1-...
متن کاملResearch Articles The use of Diarylethene Derivatives for Photo-switching | TCI
The process of reversible coloration changes induced at least in one-direction by photoirradiation is referred to as photochromism.1) The two isomers of photochromic compounds differ in their geometrical and electrical structures. These geometrical and electrical differences lead to changes in the physical properties of the molecules, such as their absorption and fluorescence spectra, refractiv...
متن کاملThe Reactions of Hydroxyl Radicals with 1,4- and 1,3-Cyclohexadiene in Aqueous Solution A Pulse Radiolysis and Product Study
The reactions of radiolytically generated hydroxyl radicals and H atoms with 1,4and 1,3-cyclohexadiene were studied by pulse radiolysis and product analysis. Hydrogen abstraction from these substrates by the O H radical yields the cyclohexadienyl radical (f (310 nm) = 4400 dm mol" cm" ' from the reaction of the H atom with benzene) with an efficiency of 50% (0.29 ,«moI / " ' ) in the case of 1,...
متن کاملذخیره در منابع من
با ذخیره ی این منبع در منابع من، دسترسی به آن را برای استفاده های بعدی آسان تر کنید
برای دانلود متن کامل این مقاله و بیش از 32 میلیون مقاله دیگر ابتدا ثبت نام کنید
ثبت ناماگر عضو سایت هستید لطفا وارد حساب کاربری خود شوید
ورودعنوان ژورنال:
- The journal of physical chemistry. A
دوره 116 14 شماره
صفحات -
تاریخ انتشار 2012