Abstract
Making use of CEPA-1, CCSD and CCSD(T) calculations with relatively large basis sets and taking the major anharmonicity effects into account, predictions are made for the following 12 molecules which are of interest to interstellar cloud chemistry: HC+3, H2C3H+, H2CCC, C3N, C2NC, HC2NC, HC2NCH+, HNC3, C5N, C4NC, NC3NC and HC4NC. Four of them (H2CCC, C3N, HC2NC and HNC3) have already been observed both in the laboratory as well as in the interstellar medium. The present predictions may be of help to spectroscopists and radioastronomers in their search for lines of the others.
Talk to us
Join us for a 30 min session where you can share your feedback and ask us any queries you have
Disclaimer: All third-party content on this website/platform is and will remain the property of their respective owners and is provided on "as is" basis without any warranties, express or implied. Use of third-party content does not indicate any affiliation, sponsorship with or endorsement by them. Any references to third-party content is to identify the corresponding services and shall be considered fair use under The CopyrightLaw.