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Geometry and Microwave Rotational Spectrum of the (FCOO center dot)-O-16-O-18 Radical

The result's identifiers

  • Result code in IS VaVaI

    <a href="https://www.isvavai.cz/riv?ss=detail&h=RIV%2F60461373%3A22340%2F13%3A43895265" target="_blank" >RIV/60461373:22340/13:43895265 - isvavai.cz</a>

  • Result on the web

    <a href="http://pubs.acs.org/doi/ipdf/10.1021/jp4054549" target="_blank" >http://pubs.acs.org/doi/ipdf/10.1021/jp4054549</a>

  • DOI - Digital Object Identifier

    <a href="http://dx.doi.org/10.1021/jp4054549" target="_blank" >10.1021/jp4054549</a>

Alternative languages

  • Result language

    angličtina

  • Original language name

    Geometry and Microwave Rotational Spectrum of the (FCOO center dot)-O-16-O-18 Radical

  • Original language description

    The rotational spectrum of an asymmetrically substituted isotopologue of the fluoroformyloxyl radical (FCOO center dot)-O-16-O-18 with resolved fine and hyperfine structures were measured and analyzed for the very first time The molecular parameters of this radical obtained from the spectral analysis were processed along with the symmetrical isotopologues (FCO2 center dot)-O-16 and (FCO2 center dot)-O-18 and accurate substitution geometry was attained. In addition to those, coupled cluster quantum chemistry calculations were Used to scale the experimental parameters, and in this manner, trustworthy values of the equilibrium and ground state geometries were derived.

  • Czech name

  • Czech description

Classification

  • Type

    J<sub>x</sub> - Unclassified - Peer-reviewed scientific article (Jimp, Jsc and Jost)

  • CEP classification

    CF - Physical chemistry and theoretical chemistry

  • OECD FORD branch

Result continuities

  • Project

    Result was created during the realization of more than one project. More information in the Projects tab.

  • Continuities

    S - Specificky vyzkum na vysokych skolach

Others

  • Publication year

    2013

  • Confidentiality

    S - Úplné a pravdivé údaje o projektu nepodléhají ochraně podle zvláštních právních předpisů

Data specific for result type

  • Name of the periodical

    Journal of Physical Chemistry A

  • ISSN

    1089-5639

  • e-ISSN

  • Volume of the periodical

    117

  • Issue of the periodical within the volume

    39

  • Country of publishing house

    US - UNITED STATES

  • Number of pages

    6

  • Pages from-to

    10138-10143

  • UT code for WoS article

    000326300600094

  • EID of the result in the Scopus database